diff options
Diffstat (limited to 'metadata/md5-cache/sci-chemistry')
47 files changed, 106 insertions, 106 deletions
diff --git a/metadata/md5-cache/sci-chemistry/GromacsWrapper-0.8.2 b/metadata/md5-cache/sci-chemistry/GromacsWrapper-0.8.2 index 963e73efec5e..011396214d36 100644 --- a/metadata/md5-cache/sci-chemistry/GromacsWrapper-0.8.2 +++ b/metadata/md5-cache/sci-chemistry/GromacsWrapper-0.8.2 @@ -1,4 +1,4 @@ -BDEPEND=dev-python/six[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] sci-libs/numkit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] test? ( >=dev-python/pandas-0.17[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) test? ( dev-python/six[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] sci-libs/numkit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/pytest-7.1.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) >=dev-python/gpep517-9[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/setuptools-65.3.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/wheel[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] +BDEPEND=dev-python/six[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] sci-libs/numkit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] test? ( >=dev-python/pandas-0.17[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) test? ( dev-python/six[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] sci-libs/numkit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/pytest-7.1.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) >=dev-python/gpep517-9[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/setuptools-65.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/wheel-0.38.4[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] DEFINED_PHASES=compile configure install prepare test unpack DESCRIPTION=Python framework for Gromacs EAPI=7 @@ -7,10 +7,10 @@ INHERIT=distutils-r1 vcs-snapshot IUSE=test python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 KEYWORDS=~amd64 ~x86 LICENSE=GPL-3 LGPL-3 -RDEPEND=dev-python/six[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] sci-libs/numkit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +RDEPEND=dev-python/six[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] sci-libs/numkit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 ) RESTRICT=!test? ( test ) SLOT=0 SRC_URI=https://github.com/Becksteinlab/GromacsWrapper/archive/release-0.8.2.tar.gz -> GromacsWrapper-0.8.2.tar.gz -_eclasses_=distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 vcs-snapshot eab6d8533446763c2e9777d8bbd1594e +_eclasses_=distutils-r1 da32ffc285e9f13313f2387570e35b87 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 vcs-snapshot eab6d8533446763c2e9777d8bbd1594e _md5_=eb9831222a6a2a9fb1f7e59d665e6255 diff --git a/metadata/md5-cache/sci-chemistry/MDAnalysis-1.0.0 b/metadata/md5-cache/sci-chemistry/MDAnalysis-1.0.0 index f789d4859606..3c73ede9daff 100644 --- a/metadata/md5-cache/sci-chemistry/MDAnalysis-1.0.0 +++ b/metadata/md5-cache/sci-chemistry/MDAnalysis-1.0.0 @@ -1,4 +1,4 @@ -BDEPEND=>=dev-python/numpy-1.13.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/scipy-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=sci-biology/biopython-1.71[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/networkx-1.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/GridDataFormats-0.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/joblib-0.12[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/matplotlib-1.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/netcdf4-python[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/mmtf-python-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/gsd-1.9.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/mock[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/duecredit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/six-1.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/tqdm-4.43.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] test? ( >=dev-python/numpy-1.13.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/scipy-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=sci-biology/biopython-1.71[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/networkx-1.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/GridDataFormats-0.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/joblib-0.12[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/matplotlib-1.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/netcdf4-python[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/mmtf-python-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/gsd-1.9.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/mock[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/duecredit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/six-1.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/tqdm-4.43.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/nose-1.3.7_p20211111_p1-r1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) >=dev-python/setuptools-65.3.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] +BDEPEND=>=dev-python/numpy-1.13.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/scipy-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=sci-biology/biopython-1.71[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/networkx-1.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/GridDataFormats-0.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/joblib-0.12[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/matplotlib-1.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/netcdf4-python[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/mmtf-python-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/gsd-1.9.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/mock[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/duecredit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/six-1.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/tqdm-4.43.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] test? ( >=dev-python/numpy-1.13.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/scipy-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=sci-biology/biopython-1.71[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/networkx-1.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/GridDataFormats-0.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/joblib-0.12[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/matplotlib-1.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/netcdf4-python[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/mmtf-python-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/gsd-1.9.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/mock[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/duecredit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/six-1.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/tqdm-4.43.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/nose-1.3.7_p20221026[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) >=dev-python/setuptools-65.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] DEFINED_PHASES=compile configure install prepare test DESCRIPTION=A python library to analyze and manipulate molecular dynamics trajectories EAPI=7 @@ -7,10 +7,10 @@ INHERIT=distutils-r1 IUSE=test test python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux LICENSE=GPL-2 -RDEPEND=>=dev-python/numpy-1.13.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/scipy-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=sci-biology/biopython-1.71[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/networkx-1.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/GridDataFormats-0.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/joblib-0.12[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/matplotlib-1.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/netcdf4-python[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/mmtf-python-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/gsd-1.9.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/mock[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/duecredit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/six-1.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/tqdm-4.43.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +RDEPEND=>=dev-python/numpy-1.13.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/scipy-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=sci-biology/biopython-1.71[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/networkx-1.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/GridDataFormats-0.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/joblib-0.12[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/matplotlib-1.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/netcdf4-python[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/mmtf-python-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/gsd-1.9.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/mock[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/duecredit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/six-1.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/tqdm-4.43.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 ) RESTRICT=!test? ( test ) SLOT=0 SRC_URI=mirror://pypi/M/MDAnalysis/MDAnalysis-1.0.0.tar.gz -_eclasses_=distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 +_eclasses_=distutils-r1 da32ffc285e9f13313f2387570e35b87 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 _md5_=e07b9d991b0ebdc5253eec932ecf80ed diff --git a/metadata/md5-cache/sci-chemistry/MDAnalysis-2.0.0 b/metadata/md5-cache/sci-chemistry/MDAnalysis-2.0.0 index 9542efae5150..b023b5642638 100644 --- a/metadata/md5-cache/sci-chemistry/MDAnalysis-2.0.0 +++ b/metadata/md5-cache/sci-chemistry/MDAnalysis-2.0.0 @@ -1,4 +1,4 @@ -BDEPEND=>=dev-python/numpy-1.16.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/scipy-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=sci-biology/biopython-1.71[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/networkx-1.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/GridDataFormats-0.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/joblib-0.12[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/matplotlib-1.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/mmtf-python-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/tqdm-4.43.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/gsd-1.9.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/threadpoolctl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] test? ( >=dev-python/numpy-1.16.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/scipy-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=sci-biology/biopython-1.71[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/networkx-1.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/GridDataFormats-0.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/joblib-0.12[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/matplotlib-1.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/mmtf-python-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/tqdm-4.43.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/gsd-1.9.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/threadpoolctl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/nose-1.3.7_p20211111_p1-r1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) >=dev-python/setuptools-65.3.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] +BDEPEND=>=dev-python/numpy-1.16.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/scipy-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=sci-biology/biopython-1.71[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/networkx-1.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/GridDataFormats-0.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/joblib-0.12[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/matplotlib-1.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/mmtf-python-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/tqdm-4.43.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/gsd-1.9.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/threadpoolctl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] test? ( >=dev-python/numpy-1.16.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/scipy-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=sci-biology/biopython-1.71[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/networkx-1.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/GridDataFormats-0.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/joblib-0.12[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/matplotlib-1.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/mmtf-python-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/tqdm-4.43.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/gsd-1.9.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/threadpoolctl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/nose-1.3.7_p20221026[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) >=dev-python/setuptools-65.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] DEFINED_PHASES=compile configure install prepare test DESCRIPTION=A python library to analyze and manipulate molecular dynamics trajectories EAPI=8 @@ -7,10 +7,10 @@ INHERIT=distutils-r1 IUSE=test python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux LICENSE=GPL-2 -RDEPEND=>=dev-python/numpy-1.16.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/scipy-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=sci-biology/biopython-1.71[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/networkx-1.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/GridDataFormats-0.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/joblib-0.12[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/matplotlib-1.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/mmtf-python-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/tqdm-4.43.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/gsd-1.9.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/threadpoolctl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +RDEPEND=>=dev-python/numpy-1.16.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/scipy-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=sci-biology/biopython-1.71[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/networkx-1.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/GridDataFormats-0.4.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/joblib-0.12[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/matplotlib-1.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/mmtf-python-1.0.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/tqdm-4.43.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/gsd-1.9.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/threadpoolctl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 ) RESTRICT=test !test? ( test ) SLOT=0 SRC_URI=mirror://pypi/M/MDAnalysis/MDAnalysis-2.0.0.tar.gz -_eclasses_=distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 +_eclasses_=distutils-r1 da32ffc285e9f13313f2387570e35b87 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 _md5_=ee1c9d9dd59c78af672cdcd2522e7f83 diff --git a/metadata/md5-cache/sci-chemistry/Manifest.gz b/metadata/md5-cache/sci-chemistry/Manifest.gz Binary files differindex 85f6a271e6da..87bd10e5c011 100644 --- a/metadata/md5-cache/sci-chemistry/Manifest.gz +++ b/metadata/md5-cache/sci-chemistry/Manifest.gz diff --git a/metadata/md5-cache/sci-chemistry/ParmEd-3.4.3 b/metadata/md5-cache/sci-chemistry/ParmEd-3.4.3 index 4ac7ff000b07..0d455373caa5 100644 --- a/metadata/md5-cache/sci-chemistry/ParmEd-3.4.3 +++ b/metadata/md5-cache/sci-chemistry/ParmEd-3.4.3 @@ -1,4 +1,4 @@ -BDEPEND=test? ( >=dev-python/pytest-7.1.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) >=dev-python/setuptools-65.3.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] +BDEPEND=test? ( >=dev-python/pytest-7.1.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) >=dev-python/setuptools-65.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] DEFINED_PHASES=compile configure install prepare test DESCRIPTION=Parameter and topology file editor and molecular mechanical simulator engine EAPI=8 @@ -7,10 +7,10 @@ INHERIT=distutils-r1 IUSE=test python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 KEYWORDS=~amd64 LICENSE=LGPL-2 -RDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +RDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 ) RESTRICT=!test? ( test ) SLOT=0 SRC_URI=https://github.com/ParmEd/ParmEd/archive/refs/tags/3.4.3.tar.gz -> ParmEd-3.4.3.tar.gz -_eclasses_=distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 +_eclasses_=distutils-r1 da32ffc285e9f13313f2387570e35b87 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 _md5_=77692821f30ef48205d108cdfb1a6b77 diff --git a/metadata/md5-cache/sci-chemistry/avogadro2-1.95.1 b/metadata/md5-cache/sci-chemistry/avogadro2-1.95.1 index 74cde50d94c4..bcdfcddcb01c 100644 --- a/metadata/md5-cache/sci-chemistry/avogadro2-1.95.1 +++ b/metadata/md5-cache/sci-chemistry/avogadro2-1.95.1 @@ -13,5 +13,5 @@ RDEPEND=dev-qt/qtcore:5 dev-qt/qtgui:5 dev-qt/qtwidgets:5 >=sci-libs/avogadrolib RESTRICT=test SLOT=0 SRC_URI=https://github.com/OpenChemistry/avogadroapp/archive/1.95.1.tar.gz -> avogadro2-1.95.1.tar.gz https://github.com/OpenChemistry/avogadro-i18n/archive/3b8a86cc37e988b043d1503d2f11068389b0aca3.tar.gz -> avogadro2-1.95.1-i18n.tar.gz -_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d desktop 7eb20ad915a0a318176d51bc2508ff5c docs 2af4a2f0074bd646101ce0f66ca6dd03 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg 6024fbc93167fad782e2032933654857 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d desktop 7eb20ad915a0a318176d51bc2508ff5c docs 2af4a2f0074bd646101ce0f66ca6dd03 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg 6024fbc93167fad782e2032933654857 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=63852b6e1a0d593b6df49dc2b1b457f0 diff --git a/metadata/md5-cache/sci-chemistry/avogadro2-1.97.0 b/metadata/md5-cache/sci-chemistry/avogadro2-1.97.0 index 7f3902366e76..dfd0830f63fb 100644 --- a/metadata/md5-cache/sci-chemistry/avogadro2-1.97.0 +++ b/metadata/md5-cache/sci-chemistry/avogadro2-1.97.0 @@ -13,5 +13,5 @@ RDEPEND=dev-qt/qtcore:5 dev-qt/qtgui:5 dev-qt/qtwidgets:5 >=sci-libs/avogadrolib RESTRICT=test SLOT=0 SRC_URI=https://github.com/OpenChemistry/avogadroapp/archive/1.97.0.tar.gz -> avogadro2-1.97.0.tar.gz https://github.com/OpenChemistry/avogadro-i18n/archive/13c4286102373658cea48a33b86536ab5793da66.tar.gz -> avogadro2-1.97.0-i18n.tar.gz -_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d desktop 7eb20ad915a0a318176d51bc2508ff5c docs 2af4a2f0074bd646101ce0f66ca6dd03 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg 6024fbc93167fad782e2032933654857 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d desktop 7eb20ad915a0a318176d51bc2508ff5c docs 2af4a2f0074bd646101ce0f66ca6dd03 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg 6024fbc93167fad782e2032933654857 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=4d16d471e4fb5d4f76219007401eda51 diff --git a/metadata/md5-cache/sci-chemistry/chemex-2022.0.1-r1 b/metadata/md5-cache/sci-chemistry/chemex-2022.0.1-r1 index 4ab42cdf22cc..19cc00a39515 100644 --- a/metadata/md5-cache/sci-chemistry/chemex-2022.0.1-r1 +++ b/metadata/md5-cache/sci-chemistry/chemex-2022.0.1-r1 @@ -1,4 +1,4 @@ -BDEPEND=test? ( python_single_target_python3_9? ( >=dev-python/asteval-0.9.25[python_targets_python3_9(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_9(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_9(-)] >=dev-python/matplotlib-3.5.3[python_targets_python3_9(-)] >=dev-python/numpy-1.23.3[python_targets_python3_9(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_9(-)] >=dev-python/rapidfuzz-2.8.0[python_targets_python3_9(-)] >=dev-python/rich-12.5.1[python_targets_python3_9(-)] >=dev-python/scipy-1.9.1[python_targets_python3_9(-)] >=dev-python/tomli-2.0.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/asteval-0.9.25[python_targets_python3_10(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_10(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_10(-)] >=dev-python/matplotlib-3.5.3[python_targets_python3_10(-)] >=dev-python/numpy-1.23.3[python_targets_python3_10(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_10(-)] >=dev-python/rapidfuzz-2.8.0[python_targets_python3_10(-)] >=dev-python/rich-12.5.1[python_targets_python3_10(-)] >=dev-python/scipy-1.9.1[python_targets_python3_10(-)] >=dev-python/tomli-2.0.1[python_targets_python3_10(-)] ) python_single_target_python3_9? ( >=dev-python/pytest-7.1.3[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/pytest-7.1.3[python_targets_python3_10(-)] ) ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_9? ( >=dev-python/gpep517-9[python_targets_python3_9(-)] >=dev-python/poetry-core-1.2.0[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/gpep517-9[python_targets_python3_10(-)] >=dev-python/poetry-core-1.2.0[python_targets_python3_10(-)] ) +BDEPEND=test? ( python_single_target_python3_9? ( >=dev-python/asteval-0.9.25[python_targets_python3_9(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_9(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_9(-)] >=dev-python/matplotlib-3.5.3[python_targets_python3_9(-)] >=dev-python/numpy-1.23.3[python_targets_python3_9(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_9(-)] >=dev-python/rapidfuzz-2.8.0[python_targets_python3_9(-)] >=dev-python/rich-12.5.1[python_targets_python3_9(-)] >=dev-python/scipy-1.9.1[python_targets_python3_9(-)] >=dev-python/tomli-2.0.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/asteval-0.9.25[python_targets_python3_10(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_10(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_10(-)] >=dev-python/matplotlib-3.5.3[python_targets_python3_10(-)] >=dev-python/numpy-1.23.3[python_targets_python3_10(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_10(-)] >=dev-python/rapidfuzz-2.8.0[python_targets_python3_10(-)] >=dev-python/rich-12.5.1[python_targets_python3_10(-)] >=dev-python/scipy-1.9.1[python_targets_python3_10(-)] >=dev-python/tomli-2.0.1[python_targets_python3_10(-)] ) python_single_target_python3_9? ( >=dev-python/pytest-7.1.3[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/pytest-7.1.3[python_targets_python3_10(-)] ) ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_9? ( >=dev-python/gpep517-9[python_targets_python3_9(-)] >=dev-python/poetry-core-1.3.2[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/gpep517-9[python_targets_python3_10(-)] >=dev-python/poetry-core-1.3.2[python_targets_python3_10(-)] ) DEFINED_PHASES=compile configure install prepare setup test DEPEND=python_single_target_python3_9? ( >=dev-python/asteval-0.9.25[python_targets_python3_9(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_9(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_9(-)] >=dev-python/matplotlib-3.5.3[python_targets_python3_9(-)] >=dev-python/numpy-1.23.3[python_targets_python3_9(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_9(-)] >=dev-python/rapidfuzz-2.8.0[python_targets_python3_9(-)] >=dev-python/rich-12.5.1[python_targets_python3_9(-)] >=dev-python/scipy-1.9.1[python_targets_python3_9(-)] >=dev-python/tomli-2.0.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/asteval-0.9.25[python_targets_python3_10(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_10(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_10(-)] >=dev-python/matplotlib-3.5.3[python_targets_python3_10(-)] >=dev-python/numpy-1.23.3[python_targets_python3_10(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_10(-)] >=dev-python/rapidfuzz-2.8.0[python_targets_python3_10(-)] >=dev-python/rich-12.5.1[python_targets_python3_10(-)] >=dev-python/scipy-1.9.1[python_targets_python3_10(-)] >=dev-python/tomli-2.0.1[python_targets_python3_10(-)] ) DESCRIPTION=Program to fit chemical exchange induced shift and relaxation data @@ -8,10 +8,10 @@ INHERIT=distutils-r1 IUSE=test test python_single_target_python3_9 python_single_target_python3_10 KEYWORDS=~amd64 LICENSE=BSD -RDEPEND=python_single_target_python3_9? ( >=dev-python/asteval-0.9.25[python_targets_python3_9(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_9(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_9(-)] >=dev-python/matplotlib-3.5.3[python_targets_python3_9(-)] >=dev-python/numpy-1.23.3[python_targets_python3_9(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_9(-)] >=dev-python/rapidfuzz-2.8.0[python_targets_python3_9(-)] >=dev-python/rich-12.5.1[python_targets_python3_9(-)] >=dev-python/scipy-1.9.1[python_targets_python3_9(-)] >=dev-python/tomli-2.0.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/asteval-0.9.25[python_targets_python3_10(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_10(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_10(-)] >=dev-python/matplotlib-3.5.3[python_targets_python3_10(-)] >=dev-python/numpy-1.23.3[python_targets_python3_10(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_10(-)] >=dev-python/rapidfuzz-2.8.0[python_targets_python3_10(-)] >=dev-python/rich-12.5.1[python_targets_python3_10(-)] >=dev-python/scipy-1.9.1[python_targets_python3_10(-)] >=dev-python/tomli-2.0.1[python_targets_python3_10(-)] ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +RDEPEND=python_single_target_python3_9? ( >=dev-python/asteval-0.9.25[python_targets_python3_9(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_9(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_9(-)] >=dev-python/matplotlib-3.5.3[python_targets_python3_9(-)] >=dev-python/numpy-1.23.3[python_targets_python3_9(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_9(-)] >=dev-python/rapidfuzz-2.8.0[python_targets_python3_9(-)] >=dev-python/rich-12.5.1[python_targets_python3_9(-)] >=dev-python/scipy-1.9.1[python_targets_python3_9(-)] >=dev-python/tomli-2.0.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/asteval-0.9.25[python_targets_python3_10(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_10(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_10(-)] >=dev-python/matplotlib-3.5.3[python_targets_python3_10(-)] >=dev-python/numpy-1.23.3[python_targets_python3_10(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_10(-)] >=dev-python/rapidfuzz-2.8.0[python_targets_python3_10(-)] >=dev-python/rich-12.5.1[python_targets_python3_10(-)] >=dev-python/scipy-1.9.1[python_targets_python3_10(-)] >=dev-python/tomli-2.0.1[python_targets_python3_10(-)] ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) REQUIRED_USE=^^ ( python_single_target_python3_9 python_single_target_python3_10 ) RESTRICT=test !test? ( test ) SLOT=0 SRC_URI=https://github.com/gbouvignies/ChemEx/archive/refs/tags/v2022.0.1.tar.gz -> chemex-2022.0.1.tar.gz -_eclasses_=distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 +_eclasses_=distutils-r1 da32ffc285e9f13313f2387570e35b87 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 _md5_=36af9a222bdf212c884b7064d6025a64 diff --git a/metadata/md5-cache/sci-chemistry/chemex-2022.1.0 b/metadata/md5-cache/sci-chemistry/chemex-2022.1.0 index a862790a3ac5..96d02490ac3b 100644 --- a/metadata/md5-cache/sci-chemistry/chemex-2022.1.0 +++ b/metadata/md5-cache/sci-chemistry/chemex-2022.1.0 @@ -1,4 +1,4 @@ -BDEPEND=test? ( python_single_target_python3_9? ( >=dev-python/asteval-0.9.25[python_targets_python3_9(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_9(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_9(-)] >=dev-python/matplotlib-3.6.1[python_targets_python3_9(-)] >=dev-python/numpy-1.23.4[python_targets_python3_9(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_9(-)] >=dev-python/rapidfuzz-2.11.0[python_targets_python3_9(-)] >=dev-python/rich-12.6.0[python_targets_python3_9(-)] >=dev-python/scipy-1.9.3[python_targets_python3_9(-)] >=dev-python/tomli-2.0.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/asteval-0.9.25[python_targets_python3_10(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_10(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_10(-)] >=dev-python/matplotlib-3.6.1[python_targets_python3_10(-)] >=dev-python/numpy-1.23.4[python_targets_python3_10(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_10(-)] >=dev-python/rapidfuzz-2.11.0[python_targets_python3_10(-)] >=dev-python/rich-12.6.0[python_targets_python3_10(-)] >=dev-python/scipy-1.9.3[python_targets_python3_10(-)] >=dev-python/tomli-2.0.1[python_targets_python3_10(-)] ) python_single_target_python3_9? ( >=dev-python/pytest-7.1.3[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/pytest-7.1.3[python_targets_python3_10(-)] ) ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_9? ( >=dev-python/gpep517-9[python_targets_python3_9(-)] >=dev-python/poetry-core-1.2.0[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/gpep517-9[python_targets_python3_10(-)] >=dev-python/poetry-core-1.2.0[python_targets_python3_10(-)] ) +BDEPEND=test? ( python_single_target_python3_9? ( >=dev-python/asteval-0.9.25[python_targets_python3_9(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_9(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_9(-)] >=dev-python/matplotlib-3.6.1[python_targets_python3_9(-)] >=dev-python/numpy-1.23.4[python_targets_python3_9(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_9(-)] >=dev-python/rapidfuzz-2.11.0[python_targets_python3_9(-)] >=dev-python/rich-12.6.0[python_targets_python3_9(-)] >=dev-python/scipy-1.9.3[python_targets_python3_9(-)] >=dev-python/tomli-2.0.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/asteval-0.9.25[python_targets_python3_10(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_10(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_10(-)] >=dev-python/matplotlib-3.6.1[python_targets_python3_10(-)] >=dev-python/numpy-1.23.4[python_targets_python3_10(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_10(-)] >=dev-python/rapidfuzz-2.11.0[python_targets_python3_10(-)] >=dev-python/rich-12.6.0[python_targets_python3_10(-)] >=dev-python/scipy-1.9.3[python_targets_python3_10(-)] >=dev-python/tomli-2.0.1[python_targets_python3_10(-)] ) python_single_target_python3_9? ( >=dev-python/pytest-7.1.3[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/pytest-7.1.3[python_targets_python3_10(-)] ) ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_9? ( >=dev-python/gpep517-9[python_targets_python3_9(-)] >=dev-python/poetry-core-1.3.2[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/gpep517-9[python_targets_python3_10(-)] >=dev-python/poetry-core-1.3.2[python_targets_python3_10(-)] ) DEFINED_PHASES=compile configure install prepare setup test DEPEND=python_single_target_python3_9? ( >=dev-python/asteval-0.9.25[python_targets_python3_9(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_9(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_9(-)] >=dev-python/matplotlib-3.6.1[python_targets_python3_9(-)] >=dev-python/numpy-1.23.4[python_targets_python3_9(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_9(-)] >=dev-python/rapidfuzz-2.11.0[python_targets_python3_9(-)] >=dev-python/rich-12.6.0[python_targets_python3_9(-)] >=dev-python/scipy-1.9.3[python_targets_python3_9(-)] >=dev-python/tomli-2.0.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/asteval-0.9.25[python_targets_python3_10(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_10(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_10(-)] >=dev-python/matplotlib-3.6.1[python_targets_python3_10(-)] >=dev-python/numpy-1.23.4[python_targets_python3_10(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_10(-)] >=dev-python/rapidfuzz-2.11.0[python_targets_python3_10(-)] >=dev-python/rich-12.6.0[python_targets_python3_10(-)] >=dev-python/scipy-1.9.3[python_targets_python3_10(-)] >=dev-python/tomli-2.0.1[python_targets_python3_10(-)] ) DESCRIPTION=Program to fit chemical exchange induced shift and relaxation data @@ -8,10 +8,10 @@ INHERIT=distutils-r1 IUSE=test test python_single_target_python3_9 python_single_target_python3_10 KEYWORDS=~amd64 LICENSE=BSD -RDEPEND=python_single_target_python3_9? ( >=dev-python/asteval-0.9.25[python_targets_python3_9(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_9(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_9(-)] >=dev-python/matplotlib-3.6.1[python_targets_python3_9(-)] >=dev-python/numpy-1.23.4[python_targets_python3_9(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_9(-)] >=dev-python/rapidfuzz-2.11.0[python_targets_python3_9(-)] >=dev-python/rich-12.6.0[python_targets_python3_9(-)] >=dev-python/scipy-1.9.3[python_targets_python3_9(-)] >=dev-python/tomli-2.0.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/asteval-0.9.25[python_targets_python3_10(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_10(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_10(-)] >=dev-python/matplotlib-3.6.1[python_targets_python3_10(-)] >=dev-python/numpy-1.23.4[python_targets_python3_10(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_10(-)] >=dev-python/rapidfuzz-2.11.0[python_targets_python3_10(-)] >=dev-python/rich-12.6.0[python_targets_python3_10(-)] >=dev-python/scipy-1.9.3[python_targets_python3_10(-)] >=dev-python/tomli-2.0.1[python_targets_python3_10(-)] ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +RDEPEND=python_single_target_python3_9? ( >=dev-python/asteval-0.9.25[python_targets_python3_9(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_9(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_9(-)] >=dev-python/matplotlib-3.6.1[python_targets_python3_9(-)] >=dev-python/numpy-1.23.4[python_targets_python3_9(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_9(-)] >=dev-python/rapidfuzz-2.11.0[python_targets_python3_9(-)] >=dev-python/rich-12.6.0[python_targets_python3_9(-)] >=dev-python/scipy-1.9.3[python_targets_python3_9(-)] >=dev-python/tomli-2.0.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/asteval-0.9.25[python_targets_python3_10(-)] >=dev-python/cachetools-5.2.0[python_targets_python3_10(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_10(-)] >=dev-python/matplotlib-3.6.1[python_targets_python3_10(-)] >=dev-python/numpy-1.23.4[python_targets_python3_10(-)] >=dev-python/pydantic-1.10.2[python_targets_python3_10(-)] >=dev-python/rapidfuzz-2.11.0[python_targets_python3_10(-)] >=dev-python/rich-12.6.0[python_targets_python3_10(-)] >=dev-python/scipy-1.9.3[python_targets_python3_10(-)] >=dev-python/tomli-2.0.1[python_targets_python3_10(-)] ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) REQUIRED_USE=^^ ( python_single_target_python3_9 python_single_target_python3_10 ) RESTRICT=test !test? ( test ) SLOT=0 SRC_URI=https://github.com/gbouvignies/ChemEx/archive/refs/tags/v2022.1.0.tar.gz -> chemex-2022.1.0.tar.gz -_eclasses_=distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 +_eclasses_=distutils-r1 da32ffc285e9f13313f2387570e35b87 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 _md5_=baa6d065a5d7949a7225fde3814f578a diff --git a/metadata/md5-cache/sci-chemistry/dssp-4.0.3 b/metadata/md5-cache/sci-chemistry/dssp-4.0.3 index 4cc12ff10f78..27015d604dac 100644 --- a/metadata/md5-cache/sci-chemistry/dssp-4.0.3 +++ b/metadata/md5-cache/sci-chemistry/dssp-4.0.3 @@ -9,5 +9,5 @@ LICENSE=BSD-2 RDEPEND=dev-libs/boost:=[zlib] >=sci-libs/libcifpp-2.0.0 SLOT=0 SRC_URI=https://github.com/PDB-REDO/dssp/archive/refs/tags/v4.0.3.tar.gz -> dssp-4.0.3.tar.gz -_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=698298b64a3f525961d7459a4748587e diff --git a/metadata/md5-cache/sci-chemistry/dssp-4.0.4 b/metadata/md5-cache/sci-chemistry/dssp-4.0.4 index 91fd727ef133..a0b4becfe1cd 100644 --- a/metadata/md5-cache/sci-chemistry/dssp-4.0.4 +++ b/metadata/md5-cache/sci-chemistry/dssp-4.0.4 @@ -9,5 +9,5 @@ LICENSE=BSD-2 RDEPEND=dev-libs/boost:=[zlib] >=sci-libs/libcifpp-2.0.0 SLOT=0 SRC_URI=https://github.com/PDB-REDO/dssp/archive/refs/tags/4.0.4.tar.gz -> dssp-4.0.4.tar.gz -_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=9b60c6ac62e034d04793a15e17516aaa diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2018.8-r1 b/metadata/md5-cache/sci-chemistry/gromacs-2018.8-r1 index d9c3c253b3b9..bb75ea32c39e 100644 --- a/metadata/md5-cache/sci-chemistry/gromacs-2018.8-r1 +++ b/metadata/md5-cache/sci-chemistry/gromacs-2018.8-r1 @@ -12,5 +12,5 @@ REQUIRED_USE=|| ( single-precision double-precision ) cuda? ( single-precision ) RESTRICT=!test? ( test ) SLOT=0/2018.8 SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2018.8.tar.gz doc? ( http://ftp.gromacs.org/manual/manual-2018.8.pdf ) test? ( https://ftp.gromacs.org/regressiontests/regressiontests-2018.8.tar.gz ) -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=d48127cfce78800006e1f61bf76d409a diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2019.6-r1 b/metadata/md5-cache/sci-chemistry/gromacs-2019.6-r1 index 1f45841ac9a5..3df4ea464351 100644 --- a/metadata/md5-cache/sci-chemistry/gromacs-2019.6-r1 +++ b/metadata/md5-cache/sci-chemistry/gromacs-2019.6-r1 @@ -12,5 +12,5 @@ REQUIRED_USE=|| ( single-precision double-precision ) cuda? ( single-precision ) RESTRICT=!test? ( test ) SLOT=0/2019.6 SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2019.6.tar.gz doc? ( http://ftp.gromacs.org/manual/manual-2019.6.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2019.6.tar.gz ) -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=b7596e0623695f863d15a7fa4a0c22e2 diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2019.6-r2 b/metadata/md5-cache/sci-chemistry/gromacs-2019.6-r2 index c81cd2e948d5..434f2ec18c8d 100644 --- a/metadata/md5-cache/sci-chemistry/gromacs-2019.6-r2 +++ b/metadata/md5-cache/sci-chemistry/gromacs-2019.6-r2 @@ -12,5 +12,5 @@ REQUIRED_USE=|| ( single-precision double-precision ) cuda? ( single-precision ) RESTRICT=!test? ( test ) SLOT=0/2019.6 SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2019.6.tar.gz doc? ( http://ftp.gromacs.org/manual/manual-2019.6.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2019.6.tar.gz ) -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=b87ea92194f8aed9b1bbe91710c30e77 diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2020.4-r1 b/metadata/md5-cache/sci-chemistry/gromacs-2020.4-r1 index 100a5b453118..ee17e5c9190e 100644 --- a/metadata/md5-cache/sci-chemistry/gromacs-2020.4-r1 +++ b/metadata/md5-cache/sci-chemistry/gromacs-2020.4-r1 @@ -1,4 +1,4 @@ -BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14 ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14 ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack DESCRIPTION=The ultimate molecular dynamics simulation package EAPI=7 @@ -7,10 +7,10 @@ INHERIT=bash-completion-r1 cmake cuda distutils-r1 flag-o-matic readme.gentoo-r1 IUSE=X blas cuda +custom-cflags +doc build-manual double-precision +fftw +gmxapi +gmxapi-legacy +hwloc lapack +lmfit mkl mpi +offensive opencl openmp +python +single-precision test +threads +tng cpu_flags_x86_sse2 cpu_flags_x86_sse4_1 cpu_flags_x86_fma4 cpu_flags_x86_avx cpu_flags_x86_avx2 python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 KEYWORDS=amd64 arm x86 ~amd64-linux ~x86-linux ~x64-macos LICENSE=LGPL-2.1 UoI-NCSA !mkl? ( !fftw? ( BSD ) !blas? ( BSD ) !lapack? ( BSD ) ) cuda? ( LGPL-3 ) threads? ( BSD ) -RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14 ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14 ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) RESTRICT=!test? ( test ) SLOT=0/2020.4 SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2020.4.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2020.4.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2020.4.tar.gz ) -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 da32ffc285e9f13313f2387570e35b87 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=a9d58ceefb0bc663f763b817d2cd1717 diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2020.7 b/metadata/md5-cache/sci-chemistry/gromacs-2020.7 index 8cb7eb53d708..8d1a668fff2f 100644 --- a/metadata/md5-cache/sci-chemistry/gromacs-2020.7 +++ b/metadata/md5-cache/sci-chemistry/gromacs-2020.7 @@ -1,4 +1,4 @@ -BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14 ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14 ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack DESCRIPTION=The ultimate molecular dynamics simulation package EAPI=8 @@ -7,10 +7,10 @@ INHERIT=bash-completion-r1 cmake cuda distutils-r1 flag-o-matic readme.gentoo-r1 IUSE=X blas cuda +custom-cflags +doc build-manual double-precision +fftw +gmxapi +gmxapi-legacy +hwloc lapack +lmfit mkl mpi +offensive opencl openmp +python +single-precision test +threads +tng cpu_flags_x86_sse2 cpu_flags_x86_sse4_1 cpu_flags_x86_fma4 cpu_flags_x86_avx cpu_flags_x86_avx2 python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 KEYWORDS=~amd64 ~arm ~x86 ~amd64-linux ~x86-linux ~x64-macos LICENSE=LGPL-2.1 UoI-NCSA !mkl? ( !fftw? ( BSD ) !blas? ( BSD ) !lapack? ( BSD ) ) cuda? ( LGPL-3 ) threads? ( BSD ) -RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14 ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14 ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) RESTRICT=!test? ( test ) SLOT=0/2020.7 SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2020.7.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2020.7.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2020.7.tar.gz ) -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 da32ffc285e9f13313f2387570e35b87 flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=a9dec67c45cdabcd7dd00665d56788ef diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2021.3-r1 b/metadata/md5-cache/sci-chemistry/gromacs-2021.3-r1 index c5fe7c980aa4..244248a91eb0 100644 --- a/metadata/md5-cache/sci-chemistry/gromacs-2021.3-r1 +++ b/metadata/md5-cache/sci-chemistry/gromacs-2021.3-r1 @@ -1,4 +1,4 @@ -BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack DESCRIPTION=The ultimate molecular dynamics simulation package EAPI=8 @@ -7,10 +7,10 @@ INHERIT=bash-completion-r1 cmake cuda distutils-r1 flag-o-matic readme.gentoo-r1 IUSE=X blas cuda +custom-cflags +doc build-manual double-precision +fftw +gmxapi +gmxapi-legacy +hwloc lapack +lmfit mkl mpi +offensive opencl openmp +python +single-precision test +threads +tng cpu_flags_x86_sse2 cpu_flags_x86_sse4_1 cpu_flags_x86_fma4 cpu_flags_x86_avx cpu_flags_x86_avx2 cpu_flags_x86_avx512f cpu_flags_arm_neon python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 KEYWORDS=amd64 arm x86 ~amd64-linux ~x86-linux ~x64-macos LICENSE=LGPL-2.1 UoI-NCSA !mkl? ( !fftw? ( BSD ) !blas? ( BSD ) !lapack? ( BSD ) ) cuda? ( LGPL-3 ) threads? ( BSD ) -RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) RESTRICT=!test? ( test ) SLOT=0/2021.3 SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2021.3.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2021.3.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2021.3.tar.gz ) -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 da32ffc285e9f13313f2387570e35b87 flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=98427c2d71209dc2b36430f4e63099a7 diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2021.5 b/metadata/md5-cache/sci-chemistry/gromacs-2021.5 index 26f0c14d7e44..d4cfd03ccee7 100644 --- a/metadata/md5-cache/sci-chemistry/gromacs-2021.5 +++ b/metadata/md5-cache/sci-chemistry/gromacs-2021.5 @@ -1,4 +1,4 @@ -BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack DESCRIPTION=The ultimate molecular dynamics simulation package EAPI=8 @@ -7,10 +7,10 @@ INHERIT=bash-completion-r1 cmake cuda distutils-r1 flag-o-matic readme.gentoo-r1 IUSE=X blas cuda +custom-cflags +doc build-manual double-precision +fftw +gmxapi +gmxapi-legacy +hwloc lapack +lmfit mkl mpi +offensive opencl openmp +python +single-precision test +threads +tng cpu_flags_x86_sse2 cpu_flags_x86_sse4_1 cpu_flags_x86_fma4 cpu_flags_x86_avx cpu_flags_x86_avx2 cpu_flags_x86_avx512f cpu_flags_arm_neon python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 KEYWORDS=~amd64 ~arm ~x86 ~amd64-linux ~x86-linux ~x64-macos LICENSE=LGPL-2.1 UoI-NCSA !mkl? ( !fftw? ( BSD ) !blas? ( BSD ) !lapack? ( BSD ) ) cuda? ( LGPL-3 ) threads? ( BSD ) -RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) RESTRICT=!test? ( test ) SLOT=0/2021.5 SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2021.5.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2021.5.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2021.5.tar.gz ) -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 da32ffc285e9f13313f2387570e35b87 flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=2b77d90efe779b2dc01a0b4a2a4fc950 diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2021.6 b/metadata/md5-cache/sci-chemistry/gromacs-2021.6 index 37a7794a9df6..bf10a9a1ac72 100644 --- a/metadata/md5-cache/sci-chemistry/gromacs-2021.6 +++ b/metadata/md5-cache/sci-chemistry/gromacs-2021.6 @@ -1,4 +1,4 @@ -BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack DESCRIPTION=The ultimate molecular dynamics simulation package EAPI=8 @@ -7,10 +7,10 @@ INHERIT=bash-completion-r1 cmake cuda distutils-r1 flag-o-matic readme.gentoo-r1 IUSE=X blas cuda +custom-cflags +doc build-manual double-precision +fftw +gmxapi +gmxapi-legacy +hwloc lapack +lmfit mkl mpi +offensive opencl openmp +python +single-precision test +threads +tng cpu_flags_x86_sse2 cpu_flags_x86_sse4_1 cpu_flags_x86_fma4 cpu_flags_x86_avx cpu_flags_x86_avx2 cpu_flags_x86_avx512f cpu_flags_arm_neon python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 KEYWORDS=~amd64 ~arm ~x86 ~amd64-linux ~x86-linux ~x64-macos LICENSE=LGPL-2.1 UoI-NCSA !mkl? ( !fftw? ( BSD ) !blas? ( BSD ) !lapack? ( BSD ) ) cuda? ( LGPL-3 ) threads? ( BSD ) -RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) RESTRICT=!test? ( test ) SLOT=0/2021.6 SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2021.6.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2021.6.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2021.6.tar.gz ) -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 da32ffc285e9f13313f2387570e35b87 flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=2b77d90efe779b2dc01a0b4a2a4fc950 diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2021.9999 b/metadata/md5-cache/sci-chemistry/gromacs-2021.9999 index 40525d52355b..da1f32ed5cc5 100644 --- a/metadata/md5-cache/sci-chemistry/gromacs-2021.9999 +++ b/metadata/md5-cache/sci-chemistry/gromacs-2021.9999 @@ -1,4 +1,4 @@ -BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) >=dev-vcs/git-1.8.2.1[curl] +BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) >=dev-vcs/git-1.8.2.1[curl] DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack DESCRIPTION=The ultimate molecular dynamics simulation package EAPI=8 @@ -7,9 +7,9 @@ INHERIT=bash-completion-r1 cmake cuda distutils-r1 flag-o-matic readme.gentoo-r1 IUSE=X blas cuda +custom-cflags +doc build-manual double-precision +fftw +gmxapi +gmxapi-legacy +hwloc lapack +lmfit mkl mpi +offensive opencl openmp +python +single-precision test +threads +tng cpu_flags_x86_sse2 cpu_flags_x86_sse4_1 cpu_flags_x86_fma4 cpu_flags_x86_avx cpu_flags_x86_avx2 cpu_flags_x86_avx512f cpu_flags_arm_neon python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 LICENSE=LGPL-2.1 UoI-NCSA !mkl? ( !fftw? ( BSD ) !blas? ( BSD ) !lapack? ( BSD ) ) cuda? ( LGPL-3 ) threads? ( BSD ) PROPERTIES=live -RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) RESTRICT=!test? ( test ) SLOT=0/2021.9999 -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb flag-o-matic 29a755b1291d64133634d80b0328f153 git-r3 2347f8fe2d392b2a091191f94be37e6f multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 da32ffc285e9f13313f2387570e35b87 flag-o-matic 29a755b1291d64133634d80b0328f153 git-r3 2347f8fe2d392b2a091191f94be37e6f multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=37783db6fed45127d7398fa432dec03d diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2022.2 b/metadata/md5-cache/sci-chemistry/gromacs-2022.2 index 2ab45ecbd1a6..d27cd3ba9a93 100644 --- a/metadata/md5-cache/sci-chemistry/gromacs-2022.2 +++ b/metadata/md5-cache/sci-chemistry/gromacs-2022.2 @@ -1,4 +1,4 @@ -BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack DESCRIPTION=The ultimate molecular dynamics simulation package EAPI=8 @@ -7,10 +7,10 @@ INHERIT=bash-completion-r1 cmake cuda distutils-r1 flag-o-matic readme.gentoo-r1 IUSE=blas clang clang-cuda cuda +custom-cflags +doc build-manual double-precision +fftw +gmxapi +gmxapi-legacy +hwloc lapack mkl mpi +offensive opencl openmp +python +single-precision test +threads +tng cpu_flags_x86_sse2 cpu_flags_x86_sse4_1 cpu_flags_x86_fma4 cpu_flags_x86_avx cpu_flags_x86_avx2 cpu_flags_x86_avx512f cpu_flags_arm_neon python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 KEYWORDS=~amd64 -arm ~arm64 ~x86 ~amd64-linux ~x86-linux ~x64-macos LICENSE=LGPL-2.1 UoI-NCSA !mkl? ( !fftw? ( BSD ) !blas? ( BSD ) !lapack? ( BSD ) ) cuda? ( LGPL-3 ) threads? ( BSD ) -RDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) <sci-chemistry/dssp-4 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +RDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) <sci-chemistry/dssp-4 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cuda? ( single-precision ) cuda? ( !opencl ) clang-cuda? ( clang cuda ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) RESTRICT=!test? ( test ) SLOT=0/2022.2 SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2022.2.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2022.2.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2022.2.tar.gz ) -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 da32ffc285e9f13313f2387570e35b87 flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=6017ac56695990e60fa079e1286c7ba4 diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2022.3 b/metadata/md5-cache/sci-chemistry/gromacs-2022.3 index 313b6b81ba7c..59eee7c6ad89 100644 --- a/metadata/md5-cache/sci-chemistry/gromacs-2022.3 +++ b/metadata/md5-cache/sci-chemistry/gromacs-2022.3 @@ -1,4 +1,4 @@ -BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack DESCRIPTION=The ultimate molecular dynamics simulation package EAPI=8 @@ -7,10 +7,10 @@ INHERIT=bash-completion-r1 cmake cuda distutils-r1 flag-o-matic readme.gentoo-r1 IUSE=blas clang clang-cuda cuda +custom-cflags +doc build-manual double-precision +fftw +gmxapi +gmxapi-legacy +hwloc lapack mkl mpi +offensive opencl openmp +python +single-precision test +threads +tng cpu_flags_x86_sse2 cpu_flags_x86_sse4_1 cpu_flags_x86_fma4 cpu_flags_x86_avx cpu_flags_x86_avx2 cpu_flags_x86_avx512f cpu_flags_arm_neon python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 KEYWORDS=~amd64 -arm ~arm64 ~x86 ~amd64-linux ~x86-linux ~x64-macos LICENSE=LGPL-2.1 UoI-NCSA !mkl? ( !fftw? ( BSD ) !blas? ( BSD ) !lapack? ( BSD ) ) cuda? ( LGPL-3 ) threads? ( BSD ) -RDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) <sci-chemistry/dssp-4 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +RDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) <sci-chemistry/dssp-4 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cuda? ( single-precision ) cuda? ( !opencl ) clang-cuda? ( clang cuda ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) RESTRICT=!test? ( test ) SLOT=0/2022.3 SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2022.3.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2022.3.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2022.3.tar.gz ) -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 da32ffc285e9f13313f2387570e35b87 flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=6017ac56695990e60fa079e1286c7ba4 diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2022.9999 b/metadata/md5-cache/sci-chemistry/gromacs-2022.9999 index b02eed1dd665..69ce332125e9 100644 --- a/metadata/md5-cache/sci-chemistry/gromacs-2022.9999 +++ b/metadata/md5-cache/sci-chemistry/gromacs-2022.9999 @@ -1,4 +1,4 @@ -BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) >=dev-vcs/git-1.8.2.1[curl] +BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) >=dev-vcs/git-1.8.2.1[curl] DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack DESCRIPTION=The ultimate molecular dynamics simulation package EAPI=8 @@ -7,9 +7,9 @@ INHERIT=bash-completion-r1 cmake cuda distutils-r1 flag-o-matic readme.gentoo-r1 IUSE=blas cuda +custom-cflags +doc build-manual double-precision +fftw +gmxapi +gmxapi-legacy +hwloc lapack mkl mpi +offensive opencl openmp +python +single-precision test +threads +tng cpu_flags_x86_sse2 cpu_flags_x86_sse4_1 cpu_flags_x86_fma4 cpu_flags_x86_avx cpu_flags_x86_avx2 cpu_flags_x86_avx512f cpu_flags_arm_neon python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 LICENSE=LGPL-2.1 UoI-NCSA !mkl? ( !fftw? ( BSD ) !blas? ( BSD ) !lapack? ( BSD ) ) cuda? ( LGPL-3 ) threads? ( BSD ) PROPERTIES=live -RDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) <sci-chemistry/dssp-4 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +RDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) <sci-chemistry/dssp-4 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) RESTRICT=!test? ( test ) SLOT=0/2022.9999 -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb flag-o-matic 29a755b1291d64133634d80b0328f153 git-r3 2347f8fe2d392b2a091191f94be37e6f multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 da32ffc285e9f13313f2387570e35b87 flag-o-matic 29a755b1291d64133634d80b0328f153 git-r3 2347f8fe2d392b2a091191f94be37e6f multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=763d089738fde7ef4f9fa28e4e523094 diff --git a/metadata/md5-cache/sci-chemistry/gromacs-9999 b/metadata/md5-cache/sci-chemistry/gromacs-9999 index e326f650b5c2..db66386e0665 100644 --- a/metadata/md5-cache/sci-chemistry/gromacs-9999 +++ b/metadata/md5-cache/sci-chemistry/gromacs-9999 @@ -1,4 +1,4 @@ -BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) >=dev-vcs/git-1.8.2.1[curl] +BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) >=dev-vcs/git-1.8.2.1[curl] DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack DESCRIPTION=The ultimate molecular dynamics simulation package EAPI=8 @@ -7,9 +7,9 @@ INHERIT=bash-completion-r1 cmake cuda distutils-r1 flag-o-matic readme.gentoo-r1 IUSE=blas cuda +custom-cflags +doc build-manual double-precision +fftw +gmxapi +gmxapi-legacy +hwloc lapack mkl mpi +offensive opencl openmp +python +single-precision test +threads +tng cpu_flags_x86_sse2 cpu_flags_x86_sse4_1 cpu_flags_x86_fma4 cpu_flags_x86_avx cpu_flags_x86_avx2 cpu_flags_x86_avx512f cpu_flags_arm_neon python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 LICENSE=LGPL-2.1 UoI-NCSA !mkl? ( !fftw? ( BSD ) !blas? ( BSD ) !lapack? ( BSD ) ) cuda? ( LGPL-3 ) threads? ( BSD ) PROPERTIES=live -RDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) <sci-chemistry/dssp-4 python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +RDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) <sci-chemistry/dssp-4 python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 python_single_target_python3_11 ) RESTRICT=!test? ( test ) SLOT=0/9999 -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb flag-o-matic 29a755b1291d64133634d80b0328f153 git-r3 2347f8fe2d392b2a091191f94be37e6f multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d cuda bbef1902e3953ff9f3a9947ebf4e56f9 distutils-r1 da32ffc285e9f13313f2387570e35b87 flag-o-matic 29a755b1291d64133634d80b0328f153 git-r3 2347f8fe2d392b2a091191f94be37e6f multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=763d089738fde7ef4f9fa28e4e523094 diff --git a/metadata/md5-cache/sci-chemistry/mdtraj-1.9.4 b/metadata/md5-cache/sci-chemistry/mdtraj-1.9.4 index fc09a6e4fe9c..25180d55207e 100644 --- a/metadata/md5-cache/sci-chemistry/mdtraj-1.9.4 +++ b/metadata/md5-cache/sci-chemistry/mdtraj-1.9.4 @@ -1,4 +1,4 @@ -BDEPEND=test? ( dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] >=dev-python/pytest-7.1.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) >=dev-python/setuptools-65.3.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?] +BDEPEND=test? ( dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] >=dev-python/pytest-7.1.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) >=dev-python/setuptools-65.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?] DEFINED_PHASES=compile configure install prepare test DEPEND=dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] test? ( dev-python/jupyter_client[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/nbformat[python_targets_python3_8(-)?,python_targets_python3_9(-)?] ) DESCRIPTION=Read, write and analyze MD trajectories with only a few lines of Python code @@ -8,10 +8,10 @@ INHERIT=distutils-r1 IUSE=test python_targets_python3_8 python_targets_python3_9 KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux LICENSE=LGPL-2.1+ -RDEPEND=dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) +RDEPEND=dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 ) RESTRICT=test SLOT=0 SRC_URI=mirror://pypi/m/mdtraj/mdtraj-1.9.4.tar.gz -_eclasses_=distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 +_eclasses_=distutils-r1 da32ffc285e9f13313f2387570e35b87 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 _md5_=621472da0f799a837b582ddd6dab5396 diff --git a/metadata/md5-cache/sci-chemistry/mdtraj-1.9.7 b/metadata/md5-cache/sci-chemistry/mdtraj-1.9.7 index 7eeda88a9ed4..ba233da63dcd 100644 --- a/metadata/md5-cache/sci-chemistry/mdtraj-1.9.7 +++ b/metadata/md5-cache/sci-chemistry/mdtraj-1.9.7 @@ -1,4 +1,4 @@ -BDEPEND=test? ( dev-python/astunparse[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pyparsing[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/pytest-7.1.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) >=dev-python/setuptools-65.3.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] +BDEPEND=test? ( dev-python/astunparse[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pyparsing[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/pytest-7.1.3[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) >=dev-python/setuptools-65.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] DEFINED_PHASES=compile configure install prepare test DEPEND=dev-python/astunparse[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pyparsing[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] test? ( dev-python/ipykernel[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/jupyter_client[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/nbformat[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] sci-libs/scikit-learn[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) DESCRIPTION=Read, write and analyze MD trajectories with only a few lines of Python code @@ -8,10 +8,10 @@ INHERIT=distutils-r1 IUSE=test python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux LICENSE=LGPL-2.1+ -RDEPEND=dev-python/astunparse[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pyparsing[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +RDEPEND=dev-python/astunparse[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pyparsing[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 ) RESTRICT=!test? ( test ) SLOT=0 SRC_URI=mirror://pypi/m/mdtraj/mdtraj-1.9.7.tar.gz -_eclasses_=distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 +_eclasses_=distutils-r1 da32ffc285e9f13313f2387570e35b87 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 _md5_=80c9f058ec0514165bed45017d07dd62 diff --git a/metadata/md5-cache/sci-chemistry/modeller-9.25 b/metadata/md5-cache/sci-chemistry/modeller-9.25 index b86ae6d0fb20..4147c047ccc9 100644 --- a/metadata/md5-cache/sci-chemistry/modeller-9.25 +++ b/metadata/md5-cache/sci-chemistry/modeller-9.25 @@ -1,4 +1,4 @@ -BDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +BDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) DEFINED_PHASES=compile config configure install postinst postrm prepare setup test DEPEND=>=dev-lang/swig-1.3 DESCRIPTION=Homology or comparative modeling of protein three-dimensional structures @@ -8,10 +8,10 @@ INHERIT=distutils-r1 IUSE=doc examples python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux LICENSE=modeller -RDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +RDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 ) RESTRICT=mirror SLOT=0 SRC_URI=https://salilab.org/modeller/9.25/modeller-9.25.tar.gz -_eclasses_=distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 +_eclasses_=distutils-r1 da32ffc285e9f13313f2387570e35b87 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 _md5_=b95991329a6a5e37067102edc03fc9c6 diff --git a/metadata/md5-cache/sci-chemistry/molequeue-0.9.0-r1 b/metadata/md5-cache/sci-chemistry/molequeue-0.9.0-r1 index fc0eade7c617..8ed5e3793af5 100644 --- a/metadata/md5-cache/sci-chemistry/molequeue-0.9.0-r1 +++ b/metadata/md5-cache/sci-chemistry/molequeue-0.9.0-r1 @@ -1,6 +1,6 @@ BDEPEND=doc? ( app-doc/doxygen ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 test? ( x11-base/xorg-server[xvfb] x11-apps/xhost ) DEFINED_PHASES=compile configure install prepare test -DEPEND=dev-qt/qtcore:5 dev-qt/qtgui:5 dev-qt/qtnetwork:5 dev-qt/qtwidgets:5 zeromq? ( python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_targets_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) net-libs/cppzmq:0= ) +DEPEND=dev-qt/qtcore:5 dev-qt/qtgui:5 dev-qt/qtnetwork:5 dev-qt/qtwidgets:5 zeromq? ( python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_targets_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) net-libs/cppzmq:0= ) DESCRIPTION=Abstract, manage and coordinate execution of tasks EAPI=7 HOMEPAGE=https://www.openchemistry.org/projects/molequeue/ @@ -8,10 +8,10 @@ INHERIT=cmake python-r1 virtualx IUSE=+client doc server test +zeromq python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 python_targets_python3_11 test KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux LICENSE=BSD -RDEPEND=dev-qt/qtcore:5 dev-qt/qtgui:5 dev-qt/qtnetwork:5 dev-qt/qtwidgets:5 zeromq? ( python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_targets_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) net-libs/cppzmq:0= ) +RDEPEND=dev-qt/qtcore:5 dev-qt/qtgui:5 dev-qt/qtnetwork:5 dev-qt/qtwidgets:5 zeromq? ( python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_targets_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) net-libs/cppzmq:0= ) REQUIRED_USE=server? ( client ) test? ( server ) zeromq? ( || ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 python_targets_python3_11 ) ) RESTRICT=test SLOT=0 SRC_URI=https://github.com/OpenChemistry/molequeue/archive/0.9.0.tar.gz -> molequeue-0.9.0.tar.gz -_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 virtualx 644887c82aefdf12001489391fca4f02 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 virtualx 644887c82aefdf12001489391fca4f02 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=c514f6a40aa78786545cbc221f21ade3 diff --git a/metadata/md5-cache/sci-chemistry/molsketch-0.7.2-r1 b/metadata/md5-cache/sci-chemistry/molsketch-0.7.2-r1 index 0d90e34f2953..5764c65d3f23 100644 --- a/metadata/md5-cache/sci-chemistry/molsketch-0.7.2-r1 +++ b/metadata/md5-cache/sci-chemistry/molsketch-0.7.2-r1 @@ -11,5 +11,5 @@ LICENSE=GPL-2 RDEPEND=>=sci-chemistry/openbabel-3:= dev-qt/qtcore:5 dev-qt/qtgui:5 dev-qt/qtnetwork:5 dev-qt/qtprintsupport:5 dev-qt/qtsvg:5 dev-qt/qtwidgets:5 SLOT=0 SRC_URI=mirror://sourceforge/project/molsketch/Molsketch/Molsketch-0.7.2-src.tar.gz -_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg 6024fbc93167fad782e2032933654857 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg 6024fbc93167fad782e2032933654857 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=bfb3b4e082b1e506b991cf3510a50f16 diff --git a/metadata/md5-cache/sci-chemistry/nmrglue-0.7 b/metadata/md5-cache/sci-chemistry/nmrglue-0.7 index 66623fe76088..31ab412a51f0 100644 --- a/metadata/md5-cache/sci-chemistry/nmrglue-0.7 +++ b/metadata/md5-cache/sci-chemistry/nmrglue-0.7 @@ -1,4 +1,4 @@ -BDEPEND=test? ( dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] >=dev-python/nose-1.3.7_p20211111_p1-r1[python_targets_python3_8(-)?,python_targets_python3_9(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) >=dev-python/setuptools-65.3.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?] +BDEPEND=test? ( dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] >=dev-python/nose-1.3.7_p20221026[python_targets_python3_8(-)?,python_targets_python3_9(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) >=dev-python/setuptools-65.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?] DEFINED_PHASES=compile configure install prepare test DEPEND=dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] DESCRIPTION=A module for working with NMR data in Python @@ -8,10 +8,10 @@ INHERIT=distutils-r1 IUSE=test python_targets_python3_8 python_targets_python3_9 KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux LICENSE=BSD -RDEPEND=dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) +RDEPEND=dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 ) RESTRICT=!test? ( test ) SLOT=0 SRC_URI=https://github.com/jjhelmus/nmrglue/releases/download/v0.7/nmrglue-0.7.tar.gz -_eclasses_=distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 +_eclasses_=distutils-r1 da32ffc285e9f13313f2387570e35b87 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 _md5_=197459a7eef5261de4cf3cb0315254ac diff --git a/metadata/md5-cache/sci-chemistry/nmrglue-0.9 b/metadata/md5-cache/sci-chemistry/nmrglue-0.9 index 36a1cd01fedc..7af129ef93b8 100644 --- a/metadata/md5-cache/sci-chemistry/nmrglue-0.9 +++ b/metadata/md5-cache/sci-chemistry/nmrglue-0.9 @@ -1,4 +1,4 @@ -BDEPEND=test? ( app-shells/tcsh ) test? ( dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/nose-1.3.7_p20211111_p1-r1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) doc? ( || ( ( >=dev-lang/python-3.10.4:3.10 >=dev-python/sphinx-4.5.0-r1[python_targets_python3_10(-)] dev-python/sphinx_rtd_theme[python_targets_python3_10(-)] dev-python/numpydoc[python_targets_python3_10(-)] ) ( >=dev-lang/python-3.9.12:3.9 >=dev-python/sphinx-4.5.0-r1[python_targets_python3_9(-)] dev-python/sphinx_rtd_theme[python_targets_python3_9(-)] dev-python/numpydoc[python_targets_python3_9(-)] ) ( >=dev-lang/python-3.8.13:3.8 >=dev-python/sphinx-4.5.0-r1[python_targets_python3_8(-)] dev-python/sphinx_rtd_theme[python_targets_python3_8(-)] dev-python/numpydoc[python_targets_python3_8(-)] ) ) ) python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) >=dev-python/gpep517-9[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/setuptools-65.3.0[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/wheel[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] +BDEPEND=test? ( app-shells/tcsh ) test? ( dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/nose-1.3.7_p20221026[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) doc? ( || ( ( >=dev-lang/python-3.10.8_p3:3.10 >=dev-python/sphinx-5.3.0[python_targets_python3_10(-)] dev-python/sphinx_rtd_theme[python_targets_python3_10(-)] dev-python/numpydoc[python_targets_python3_10(-)] ) ( >=dev-lang/python-3.9.15_p3:3.9 >=dev-python/sphinx-5.3.0[python_targets_python3_9(-)] dev-python/sphinx_rtd_theme[python_targets_python3_9(-)] dev-python/numpydoc[python_targets_python3_9(-)] ) ( >=dev-lang/python-3.8.15_p3:3.8 >=dev-python/sphinx-5.3.0[python_targets_python3_8(-)] dev-python/sphinx_rtd_theme[python_targets_python3_8(-)] dev-python/numpydoc[python_targets_python3_8(-)] ) ) ) python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) >=dev-python/gpep517-9[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/setuptools-65.5.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/wheel-0.38.4[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] DEFINED_PHASES=compile configure install prepare test DEPEND=dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] DESCRIPTION=A module for working with NMR data in Python @@ -8,10 +8,10 @@ INHERIT=distutils-r1 IUSE=test doc python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux LICENSE=BSD -RDEPEND=dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +RDEPEND=dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 ) RESTRICT=test !test? ( test ) SLOT=0 SRC_URI=https://github.com/jjhelmus/nmrglue/archive/v0.9.tar.gz -> nmrglue-0.9.tar.gz -_eclasses_=distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 +_eclasses_=distutils-r1 da32ffc285e9f13313f2387570e35b87 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 _md5_=d295ede89b0452cc2f4fe73e43e8b492 diff --git a/metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p20210225 b/metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p20210225 index 449416369ad2..a9d5cfefc63d 100644 --- a/metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p20210225 +++ b/metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p20210225 @@ -1,6 +1,6 @@ BDEPEND=dev-lang/perl doc? ( app-doc/doxygen dev-texlive/texlive-latex ) perl? ( >=dev-lang/swig-2 ) python? ( >=dev-lang/swig-2 ) test? ( dev-lang/python ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 DEFINED_PHASES=compile configure install postinst postrm prepare pretend setup test -DEPEND=dev-cpp/eigen:3 dev-libs/libxml2:2 sys-libs/zlib:= inchi? ( sci-libs/inchi ) json? ( >=dev-libs/rapidjson-1.1.0 ) png? ( x11-libs/cairo ) python? ( python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) ) wxwidgets? ( x11-libs/wxGTK:3.0-gtk3[X] ) perl? ( dev-lang/perl ) +DEPEND=dev-cpp/eigen:3 dev-libs/libxml2:2 sys-libs/zlib:= inchi? ( sci-libs/inchi ) json? ( >=dev-libs/rapidjson-1.1.0 ) png? ( x11-libs/cairo ) python? ( python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) ) wxwidgets? ( x11-libs/wxGTK:3.0-gtk3[X] ) perl? ( dev-lang/perl ) DESCRIPTION=Interconverts file formats used in molecular modeling EAPI=8 HOMEPAGE=https://openbabel.org/ @@ -8,10 +8,10 @@ INHERIT=cmake desktop flag-o-matic perl-functions python-r1 toolchain-funcs wxwi IUSE=cpu_flags_arm_neon cpu_flags_x86_sse2 cpu_flags_x86_sse4_2 doc examples +inchi json minimal openmp perl png python test wxwidgets python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 KEYWORDS=amd64 ~arm x86 ~amd64-linux ~x86-linux ~ppc-macos LICENSE=GPL-2 -RDEPEND=dev-cpp/eigen:3 dev-libs/libxml2:2 sys-libs/zlib:= inchi? ( sci-libs/inchi ) json? ( >=dev-libs/rapidjson-1.1.0 ) png? ( x11-libs/cairo ) python? ( python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) ) wxwidgets? ( x11-libs/wxGTK:3.0-gtk3[X] ) perl? ( dev-lang/perl:= !sci-chemistry/openbabel-perl ) +RDEPEND=dev-cpp/eigen:3 dev-libs/libxml2:2 sys-libs/zlib:= inchi? ( sci-libs/inchi ) json? ( >=dev-libs/rapidjson-1.1.0 ) png? ( x11-libs/cairo ) python? ( python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) ) wxwidgets? ( x11-libs/wxGTK:3.0-gtk3[X] ) perl? ( dev-lang/perl:= !sci-chemistry/openbabel-perl ) REQUIRED_USE=python? ( || ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 ) ) test? ( inchi json !minimal wxwidgets ) RESTRICT=!test? ( test ) SLOT=0/7.0.0 SRC_URI=https://github.com/openbabel/openbabel/archive/08e23f39b0cc39b4eebd937a5a2ffc1a7bac3e1b.tar.gz -> openbabel-3.1.1_p20210225.tar.gz https://openbabel.org/docs/dev/_static/babel130.png -> openbabel.png http://openbabel.org/OBTitle.jpg -> openbabel.jpg -_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d desktop 7eb20ad915a0a318176d51bc2508ff5c flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 perl-functions c3fca037246e877693badea0df3b0ef8 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wxwidgets c09e9b94378cadaf6ef86ec1534c0fd6 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d desktop 7eb20ad915a0a318176d51bc2508ff5c flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 perl-functions c3fca037246e877693badea0df3b0ef8 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wxwidgets c09e9b94378cadaf6ef86ec1534c0fd6 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=219030e81d976d743129dc077888bef8 diff --git a/metadata/md5-cache/sci-chemistry/openbabel-9999 b/metadata/md5-cache/sci-chemistry/openbabel-9999 index d8902753e00d..6ca91823ece9 100644 --- a/metadata/md5-cache/sci-chemistry/openbabel-9999 +++ b/metadata/md5-cache/sci-chemistry/openbabel-9999 @@ -1,6 +1,6 @@ BDEPEND=dev-lang/perl doc? ( app-doc/doxygen dev-texlive/texlive-latex ) perl? ( >=dev-lang/swig-2 ) python? ( >=dev-lang/swig-2 ) test? ( dev-lang/python ) >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 >=dev-vcs/git-1.8.2.1[curl] DEFINED_PHASES=compile configure install postinst postrm prepare pretend setup test unpack -DEPEND=dev-cpp/eigen:3 dev-libs/libxml2:2 sys-libs/zlib:= inchi? ( sci-libs/inchi ) json? ( >=dev-libs/rapidjson-1.1.0 ) png? ( x11-libs/cairo ) python? ( python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) ) wxwidgets? ( x11-libs/wxGTK:3.0-gtk3[X] ) perl? ( dev-lang/perl ) +DEPEND=dev-cpp/eigen:3 dev-libs/libxml2:2 sys-libs/zlib:= inchi? ( sci-libs/inchi ) json? ( >=dev-libs/rapidjson-1.1.0 ) png? ( x11-libs/cairo ) python? ( python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) ) wxwidgets? ( x11-libs/wxGTK:3.0-gtk3[X] ) perl? ( dev-lang/perl ) DESCRIPTION=Interconverts file formats used in molecular modeling EAPI=8 HOMEPAGE=https://openbabel.org/ @@ -8,10 +8,10 @@ INHERIT=cmake desktop flag-o-matic perl-functions python-r1 toolchain-funcs wxwi IUSE=cpu_flags_arm_neon cpu_flags_x86_sse2 cpu_flags_x86_sse4_2 doc examples +inchi json minimal openmp perl png python test wxwidgets python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 LICENSE=GPL-2 PROPERTIES=live -RDEPEND=dev-cpp/eigen:3 dev-libs/libxml2:2 sys-libs/zlib:= inchi? ( sci-libs/inchi ) json? ( >=dev-libs/rapidjson-1.1.0 ) png? ( x11-libs/cairo ) python? ( python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) ) wxwidgets? ( x11-libs/wxGTK:3.0-gtk3[X] ) perl? ( dev-lang/perl:= !sci-chemistry/openbabel-perl ) +RDEPEND=dev-cpp/eigen:3 dev-libs/libxml2:2 sys-libs/zlib:= inchi? ( sci-libs/inchi ) json? ( >=dev-libs/rapidjson-1.1.0 ) png? ( x11-libs/cairo ) python? ( python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) ) wxwidgets? ( x11-libs/wxGTK:3.0-gtk3[X] ) perl? ( dev-lang/perl:= !sci-chemistry/openbabel-perl ) REQUIRED_USE=python? ( || ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 ) ) test? ( inchi json !minimal wxwidgets ) RESTRICT=!test? ( test ) SLOT=0/7.0.0 SRC_URI=https://openbabel.org/docs/dev/_static/babel130.png -> openbabel.png http://openbabel.org/OBTitle.jpg -> openbabel.jpg -_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d desktop 7eb20ad915a0a318176d51bc2508ff5c flag-o-matic 29a755b1291d64133634d80b0328f153 git-r3 2347f8fe2d392b2a091191f94be37e6f multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 perl-functions c3fca037246e877693badea0df3b0ef8 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wxwidgets c09e9b94378cadaf6ef86ec1534c0fd6 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d desktop 7eb20ad915a0a318176d51bc2508ff5c flag-o-matic 29a755b1291d64133634d80b0328f153 git-r3 2347f8fe2d392b2a091191f94be37e6f multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 perl-functions c3fca037246e877693badea0df3b0ef8 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wxwidgets c09e9b94378cadaf6ef86ec1534c0fd6 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=b125d73885867c3083da967d79d004a0 diff --git a/metadata/md5-cache/sci-chemistry/pdbcat-1.3-r1 b/metadata/md5-cache/sci-chemistry/pdbcat-1.3-r1 index fc72b6447975..7b3eb95c4d8e 100644 --- a/metadata/md5-cache/sci-chemistry/pdbcat-1.3-r1 +++ b/metadata/md5-cache/sci-chemistry/pdbcat-1.3-r1 @@ -8,5 +8,5 @@ KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux LICENSE=free-noncomm SLOT=0 SRC_URI=http://www.ks.uiuc.edu/Development/MDTools/pdbcat/files/pdbcat-1.3.tar.gz -_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=468efdc0276a4b9606711e3ba7fc6d8f diff --git a/metadata/md5-cache/sci-chemistry/pdbmat-3.89-r1 b/metadata/md5-cache/sci-chemistry/pdbmat-3.89-r1 index 82dca40f48cb..8b989d4f080d 100644 --- a/metadata/md5-cache/sci-chemistry/pdbmat-3.89-r1 +++ b/metadata/md5-cache/sci-chemistry/pdbmat-3.89-r1 @@ -11,5 +11,5 @@ LICENSE=CeCILL-2 RDEPEND=virtual/fortran SLOT=0 SRC_URI=http://ecole.modelisation.free.fr/enm2011.tar.gz -> pdbmat-3.89.tar.gz -_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d flag-o-matic 29a755b1291d64133634d80b0328f153 fortran-2 72d28c6872beb1e7cb99684b0ae4715d multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d flag-o-matic 29a755b1291d64133634d80b0328f153 fortran-2 72d28c6872beb1e7cb99684b0ae4715d multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=d9c289801412f2ea4102c59abe9d1df7 diff --git a/metadata/md5-cache/sci-chemistry/propka-3.4.0 b/metadata/md5-cache/sci-chemistry/propka-3.4.0 index dc441f645f40..871a003c9109 100644 --- a/metadata/md5-cache/sci-chemistry/propka-3.4.0 +++ b/metadata/md5-cache/sci-chemistry/propka-3.4.0 @@ -1,4 +1,4 @@ -BDEPEND=test? ( dev-python/numpy[python_targets_python3_9(-)?,python_targets_python3_10(-)?,python_targets_python3_11(-)?] >=dev-python/pytest-7.1.3[python_targets_python3_9(-)?,python_targets_python3_10(-)?,python_targets_python3_11(-)?] ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_targets_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) >=dev-python/gpep517-9[python_targets_python3_9(-)?,python_targets_python3_10(-)?,python_targets_python3_11(-)?] >=dev-python/setuptools-65.3.0[python_targets_python3_9(-)?,python_targets_python3_10(-)?,python_targets_python3_11(-)?] dev-python/wheel[python_targets_python3_9(-)?,python_targets_python3_10(-)?,python_targets_python3_11(-)?] +BDEPEND=test? ( dev-python/numpy[python_targets_python3_9(-)?,python_targets_python3_10(-)?,python_targets_python3_11(-)?] >=dev-python/pytest-7.1.3[python_targets_python3_9(-)?,python_targets_python3_10(-)?,python_targets_python3_11(-)?] ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_targets_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) >=dev-python/gpep517-9[python_targets_python3_9(-)?,python_targets_python3_10(-)?,python_targets_python3_11(-)?] >=dev-python/setuptools-65.5.1[python_targets_python3_9(-)?,python_targets_python3_10(-)?,python_targets_python3_11(-)?] >=dev-python/wheel-0.38.4[python_targets_python3_9(-)?,python_targets_python3_10(-)?,python_targets_python3_11(-)?] DEFINED_PHASES=compile configure install prepare test DESCRIPTION=pKa-value prediction of ionizable groups in protein and protein-ligand complexes EAPI=8 @@ -7,10 +7,10 @@ INHERIT=distutils-r1 IUSE=test python_targets_python3_9 python_targets_python3_10 python_targets_python3_11 KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux LICENSE=LGPL-2.1 -RDEPEND=dev-python/numpy[python_targets_python3_9(-)?,python_targets_python3_10(-)?,python_targets_python3_11(-)?] python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_targets_python3_11? ( >=dev-lang/python-3.11.0_beta4:3.11 ) +RDEPEND=dev-python/numpy[python_targets_python3_9(-)?,python_targets_python3_10(-)?,python_targets_python3_11(-)?] python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_targets_python3_11? ( >=dev-lang/python-3.11.0_p2:3.11 ) REQUIRED_USE=|| ( python_targets_python3_9 python_targets_python3_10 python_targets_python3_11 ) RESTRICT=!test? ( test ) SLOT=0 SRC_URI=https://github.com/jensengroup/propka/archive/refs/tags/v3.4.0.tar.gz -> propka-3.4.0.gh.tar.gz -_eclasses_=distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 +_eclasses_=distutils-r1 da32ffc285e9f13313f2387570e35b87 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 _md5_=df9c2734ddc4d3199b2a42247a6a9496 diff --git a/metadata/md5-cache/sci-chemistry/pymol-2.5.0 b/metadata/md5-cache/sci-chemistry/pymol-2.5.0 index 872252859272..1d1b5259985b 100644 --- a/metadata/md5-cache/sci-chemistry/pymol-2.5.0 +++ b/metadata/md5-cache/sci-chemistry/pymol-2.5.0 @@ -1,4 +1,4 @@ -BDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +BDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) DEFINED_PHASES=compile configure install postinst postrm preinst prepare test DEPEND=dev-libs/msgpack[cxx] dev-libs/mmtf-cpp dev-python/pyopengl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/PyQt5[opengl,python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pmw[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] media-libs/freetype:2 media-libs/glew:0= media-libs/glm media-libs/libpng:0= media-video/mpeg-tools sys-libs/zlib netcdf? ( sci-libs/netcdf:0= ) dev-util/desktop-file-utils x11-misc/shared-mime-info DESCRIPTION=A Python-extensible molecular graphics system @@ -8,10 +8,10 @@ INHERIT=desktop flag-o-matic xdg distutils-r1 IUSE=+netcdf web python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux ~x64-macos LICENSE=PSF-2.2 -RDEPEND=dev-libs/msgpack[cxx] dev-libs/mmtf-cpp dev-python/pyopengl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/PyQt5[opengl,python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pmw[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] media-libs/freetype:2 media-libs/glew:0= media-libs/glm media-libs/libpng:0= media-video/mpeg-tools sys-libs/zlib netcdf? ( sci-libs/netcdf:0= ) sci-chemistry/chemical-mime-data python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +RDEPEND=dev-libs/msgpack[cxx] dev-libs/mmtf-cpp dev-python/pyopengl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/PyQt5[opengl,python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pmw[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] media-libs/freetype:2 media-libs/glew:0= media-libs/glm media-libs/libpng:0= media-video/mpeg-tools sys-libs/zlib netcdf? ( sci-libs/netcdf:0= ) sci-chemistry/chemical-mime-data python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 ) RESTRICT=mirror SLOT=0 SRC_URI=https://dev.gentoo.org/~pacho/pymol/pymol-1.8.4.0.png.xz https://github.com/schrodinger/pymol-open-source/archive/v2.5.0.tar.gz -> pymol-2.5.0.tar.gz -_eclasses_=desktop 7eb20ad915a0a318176d51bc2508ff5c distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg 6024fbc93167fad782e2032933654857 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=desktop 7eb20ad915a0a318176d51bc2508ff5c distutils-r1 da32ffc285e9f13313f2387570e35b87 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg 6024fbc93167fad782e2032933654857 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=7bb4d93e554e41f93f1e3959c541e38c diff --git a/metadata/md5-cache/sci-chemistry/pymol-2.5.0-r1 b/metadata/md5-cache/sci-chemistry/pymol-2.5.0-r1 index 947938479c62..8a360f074174 100644 --- a/metadata/md5-cache/sci-chemistry/pymol-2.5.0-r1 +++ b/metadata/md5-cache/sci-chemistry/pymol-2.5.0-r1 @@ -1,4 +1,4 @@ -BDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +BDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) DEFINED_PHASES=compile configure install postinst postrm preinst prepare test DEPEND=dev-libs/msgpack[cxx] dev-libs/mmtf-cpp dev-python/pyopengl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/PyQt5[opengl,python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pmw[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] media-libs/freetype:2 media-libs/glew:0= media-libs/glm media-libs/libpng:0= media-video/mpeg-tools sys-libs/zlib netcdf? ( sci-libs/netcdf:0= ) DESCRIPTION=A Python-extensible molecular graphics system @@ -9,9 +9,9 @@ INHERIT=desktop flag-o-matic xdg distutils-r1 IUSE=+netcdf web python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux ~x64-macos LICENSE=BitstreamVera BSD freedist HPND OFL public-domain UoI-NCSA -RDEPEND=dev-libs/msgpack[cxx] dev-libs/mmtf-cpp dev-python/pyopengl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/PyQt5[opengl,python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pmw[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] media-libs/freetype:2 media-libs/glew:0= media-libs/glm media-libs/libpng:0= media-video/mpeg-tools sys-libs/zlib netcdf? ( sci-libs/netcdf:0= ) sci-chemistry/chemical-mime-data python_targets_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) +RDEPEND=dev-libs/msgpack[cxx] dev-libs/mmtf-cpp dev-python/pyopengl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/PyQt5[opengl,python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pmw[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] media-libs/freetype:2 media-libs/glew:0= media-libs/glm media-libs/libpng:0= media-video/mpeg-tools sys-libs/zlib netcdf? ( sci-libs/netcdf:0= ) sci-chemistry/chemical-mime-data python_targets_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 ) SLOT=0 SRC_URI=https://dev.gentoo.org/~pacho/pymol/pymol-1.8.4.0.png.xz https://github.com/schrodinger/pymol-open-source/archive/v2.5.0.tar.gz -> pymol-2.5.0.tar.gz -_eclasses_=desktop 7eb20ad915a0a318176d51bc2508ff5c distutils-r1 8c1ceb6b71a65547b0ea7bc901d906cb flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg 6024fbc93167fad782e2032933654857 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=desktop 7eb20ad915a0a318176d51bc2508ff5c distutils-r1 da32ffc285e9f13313f2387570e35b87 flag-o-matic 29a755b1291d64133634d80b0328f153 multibuild d26d81f242cb193d899a72bca423d0bd multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-r1 2d51fd03931e743811ce30d198e4dcfd python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg 6024fbc93167fad782e2032933654857 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=8320b4b690e8f97a7400d54894534d09 diff --git a/metadata/md5-cache/sci-chemistry/tm-align-20150914-r1 b/metadata/md5-cache/sci-chemistry/tm-align-20150914-r1 index 215e5dc07bc0..c46fa5522aea 100644 --- a/metadata/md5-cache/sci-chemistry/tm-align-20150914-r1 +++ b/metadata/md5-cache/sci-chemistry/tm-align-20150914-r1 @@ -11,5 +11,5 @@ LICENSE=tm-align RDEPEND=virtual/fortran SLOT=0 SRC_URI=http://zhanglab.ccmb.med.umich.edu/TM-align/TMtools20150914.tar.gz -_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d flag-o-matic 29a755b1291d64133634d80b0328f153 fortran-2 72d28c6872beb1e7cb99684b0ae4715d multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d flag-o-matic 29a755b1291d64133634d80b0328f153 fortran-2 72d28c6872beb1e7cb99684b0ae4715d multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=c0efb6c6f33b081376d1b36ca966aff2 diff --git a/metadata/md5-cache/sci-chemistry/vmd-1.9.4_alpha57 b/metadata/md5-cache/sci-chemistry/vmd-1.9.4_alpha57 index 4341127d28ba..419900d5a0a6 100644 --- a/metadata/md5-cache/sci-chemistry/vmd-1.9.4_alpha57 +++ b/metadata/md5-cache/sci-chemistry/vmd-1.9.4_alpha57 @@ -1,6 +1,6 @@ BDEPEND=virtual/pkgconfig dev-lang/swig DEFINED_PHASES=compile configure install nofetch postinst postrm preinst prepare setup -DEPEND=python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_8? ( dev-python/numpy[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/numpy[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/numpy[python_targets_python3_10(-)] ) >=dev-lang/tk-8.6.1:0= dev-lang/perl dev-libs/expat sci-libs/netcdf:0= virtual/opengl >=x11-libs/fltk-1.1.10-r2:1 x11-libs/libXft x11-libs/libXi cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1:= ) gromacs? ( >=sci-chemistry/gromacs-5.0.4-r1:0=[tng] ) sqlite? ( dev-db/sqlite:3= ) tachyon? ( >=media-gfx/tachyon-0.99_beta6 ) xinerama? ( x11-libs/libXinerama ) +DEPEND=python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_8? ( dev-python/numpy[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/numpy[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/numpy[python_targets_python3_10(-)] ) >=dev-lang/tk-8.6.1:0= dev-lang/perl dev-libs/expat sci-libs/netcdf:0= virtual/opengl >=x11-libs/fltk-1.1.10-r2:1 x11-libs/libXft x11-libs/libXi cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1:= ) gromacs? ( >=sci-chemistry/gromacs-5.0.4-r1:0=[tng] ) sqlite? ( dev-db/sqlite:3= ) tachyon? ( >=media-gfx/tachyon-0.99_beta6 ) xinerama? ( x11-libs/libXinerama ) DESCRIPTION=Visual Molecular Dynamics EAPI=8 HOMEPAGE=http://www.ks.uiuc.edu/Research/vmd/ @@ -9,10 +9,10 @@ INHERIT=cuda desktop flag-o-matic prefix python-single-r1 toolchain-funcs xdg IUSE=cuda gromacs msms povray sqlite tachyon xinerama python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux LICENSE=vmd -RDEPEND=python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) python_single_target_python3_8? ( dev-python/numpy[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/numpy[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/numpy[python_targets_python3_10(-)] ) >=dev-lang/tk-8.6.1:0= dev-lang/perl dev-libs/expat sci-libs/netcdf:0= virtual/opengl >=x11-libs/fltk-1.1.10-r2:1 x11-libs/libXft x11-libs/libXi cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1:= ) gromacs? ( >=sci-chemistry/gromacs-5.0.4-r1:0=[tng] ) sqlite? ( dev-db/sqlite:3= ) tachyon? ( >=media-gfx/tachyon-0.99_beta6 ) xinerama? ( x11-libs/libXinerama ) sci-biology/stride sci-chemistry/chemical-mime-data sci-chemistry/surf x11-misc/xdg-utils x11-terms/xterm msms? ( sci-chemistry/msms-bin ) povray? ( media-gfx/povray ) +RDEPEND=python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) python_single_target_python3_8? ( dev-python/numpy[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/numpy[python_targets_python3_9(-)] ) python_single_target_python3_10? ( dev-python/numpy[python_targets_python3_10(-)] ) >=dev-lang/tk-8.6.1:0= dev-lang/perl dev-libs/expat sci-libs/netcdf:0= virtual/opengl >=x11-libs/fltk-1.1.10-r2:1 x11-libs/libXft x11-libs/libXi cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1:= ) gromacs? ( >=sci-chemistry/gromacs-5.0.4-r1:0=[tng] ) sqlite? ( dev-db/sqlite:3= ) tachyon? ( >=media-gfx/tachyon-0.99_beta6 ) xinerama? ( x11-libs/libXinerama ) sci-biology/stride sci-chemistry/chemical-mime-data sci-chemistry/surf x11-misc/xdg-utils x11-terms/xterm msms? ( sci-chemistry/msms-bin ) povray? ( media-gfx/povray ) REQUIRED_USE=^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 ) RESTRICT=fetch SLOT=0 SRC_URI=vmd-1.9.4a57.src.tar.gz fetch+https://dev.gentoo.org/~pacho/vmd/vmd-1.9.4_alpha57-gentoo-patches.tar.xz -_eclasses_=cuda bbef1902e3953ff9f3a9947ebf4e56f9 desktop 7eb20ad915a0a318176d51bc2508ff5c flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 prefix eab3c99d77fe00506c109c8a736186f7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg 6024fbc93167fad782e2032933654857 xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=cuda bbef1902e3953ff9f3a9947ebf4e56f9 desktop 7eb20ad915a0a318176d51bc2508ff5c flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 prefix eab3c99d77fe00506c109c8a736186f7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 xdg 6024fbc93167fad782e2032933654857 xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=2bbc8350e0b2d9da91e7e20f2c26fbf0 diff --git a/metadata/md5-cache/sci-chemistry/votca-2022 b/metadata/md5-cache/sci-chemistry/votca-2022 index 5964c409a002..b4eedec845e4 100644 --- a/metadata/md5-cache/sci-chemistry/votca-2022 +++ b/metadata/md5-cache/sci-chemistry/votca-2022 @@ -1,6 +1,6 @@ BDEPEND=virtual/pkgconfig >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 DEFINED_PHASES=compile configure install postinst prepare setup test -DEPEND=!sci-libs/votca-tools !sci-chemistry/votca-csg !sci-chemistry/votca-xtp python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) app-shells/bash:* >=dev-cpp/eigen-3.3 dev-libs/boost:= dev-libs/expat sci-libs/fftw:3.0= dev-lang/perl gromacs? ( sci-chemistry/gromacs:=[gmxapi-legacy(+)] ) sci-libs/hdf5[cxx] sci-libs/libxc sci-libs/libint:2 +DEPEND=!sci-libs/votca-tools !sci-chemistry/votca-csg !sci-chemistry/votca-xtp python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) app-shells/bash:* >=dev-cpp/eigen-3.3 dev-libs/boost:= dev-libs/expat sci-libs/fftw:3.0= dev-lang/perl gromacs? ( sci-chemistry/gromacs:=[gmxapi-legacy(+)] ) sci-libs/hdf5[cxx] sci-libs/libxc sci-libs/libint:2 DESCRIPTION=Versatile Object-oriented Toolkit for Coarse-graining Applications EAPI=7 HOMEPAGE=https://www.votca.org/ @@ -8,10 +8,10 @@ INHERIT=bash-completion-r1 cmake python-single-r1 IUSE=+gromacs test python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 KEYWORDS=amd64 x86 ~amd64-linux LICENSE=Apache-2.0 -RDEPEND=!sci-libs/votca-tools !sci-chemistry/votca-csg !sci-chemistry/votca-xtp python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) app-shells/bash:* >=dev-cpp/eigen-3.3 dev-libs/boost:= dev-libs/expat sci-libs/fftw:3.0= dev-lang/perl gromacs? ( sci-chemistry/gromacs:=[gmxapi-legacy(+)] ) sci-libs/hdf5[cxx] sci-libs/libxc sci-libs/libint:2 +RDEPEND=!sci-libs/votca-tools !sci-chemistry/votca-csg !sci-chemistry/votca-xtp python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) app-shells/bash:* >=dev-cpp/eigen-3.3 dev-libs/boost:= dev-libs/expat sci-libs/fftw:3.0= dev-lang/perl gromacs? ( sci-chemistry/gromacs:=[gmxapi-legacy(+)] ) sci-libs/hdf5[cxx] sci-libs/libxc sci-libs/libint:2 REQUIRED_USE=^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 ) RESTRICT=!test? ( test ) SLOT=0 SRC_URI=https://github.com/votca/votca/archive/v2022.tar.gz -> votca-2022.tar.gz -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=715c58a911a5aa30ab5e914b627a036d diff --git a/metadata/md5-cache/sci-chemistry/votca-9999 b/metadata/md5-cache/sci-chemistry/votca-9999 index c0db66061dbb..67c7ce2f79fa 100644 --- a/metadata/md5-cache/sci-chemistry/votca-9999 +++ b/metadata/md5-cache/sci-chemistry/votca-9999 @@ -1,6 +1,6 @@ BDEPEND=virtual/pkgconfig >=dev-util/ninja-1.8.2 >=dev-util/cmake-3.20.5 >=dev-vcs/git-1.8.2.1[curl] DEFINED_PHASES=compile configure install postinst prepare setup test unpack -DEPEND=!sci-libs/votca-tools !sci-chemistry/votca-csg !sci-chemistry/votca-xtp python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) app-shells/bash:* >=dev-cpp/eigen-3.3 dev-libs/boost:= dev-libs/expat sci-libs/fftw:3.0= dev-lang/perl gromacs? ( sci-chemistry/gromacs:=[gmxapi-legacy(+)] ) sci-libs/hdf5[cxx] sci-libs/libxc sci-libs/libint:2 +DEPEND=!sci-libs/votca-tools !sci-chemistry/votca-csg !sci-chemistry/votca-xtp python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) app-shells/bash:* >=dev-cpp/eigen-3.3 dev-libs/boost:= dev-libs/expat sci-libs/fftw:3.0= dev-lang/perl gromacs? ( sci-chemistry/gromacs:=[gmxapi-legacy(+)] ) sci-libs/hdf5[cxx] sci-libs/libxc sci-libs/libint:2 DESCRIPTION=Versatile Object-oriented Toolkit for Coarse-graining Applications EAPI=7 HOMEPAGE=https://www.votca.org/ @@ -8,9 +8,9 @@ INHERIT=bash-completion-r1 cmake python-single-r1 git-r3 IUSE=+gromacs test python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 LICENSE=Apache-2.0 PROPERTIES=live -RDEPEND=!sci-libs/votca-tools !sci-chemistry/votca-csg !sci-chemistry/votca-xtp python_single_target_python3_8? ( >=dev-lang/python-3.8.13:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.12:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.4:3.10 ) app-shells/bash:* >=dev-cpp/eigen-3.3 dev-libs/boost:= dev-libs/expat sci-libs/fftw:3.0= dev-lang/perl gromacs? ( sci-chemistry/gromacs:=[gmxapi-legacy(+)] ) sci-libs/hdf5[cxx] sci-libs/libxc sci-libs/libint:2 +RDEPEND=!sci-libs/votca-tools !sci-chemistry/votca-csg !sci-chemistry/votca-xtp python_single_target_python3_8? ( >=dev-lang/python-3.8.15_p3:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.15_p3:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.8_p3:3.10 ) app-shells/bash:* >=dev-cpp/eigen-3.3 dev-libs/boost:= dev-libs/expat sci-libs/fftw:3.0= dev-lang/perl gromacs? ( sci-chemistry/gromacs:=[gmxapi-legacy(+)] ) sci-libs/hdf5[cxx] sci-libs/libxc sci-libs/libint:2 REQUIRED_USE=^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 ) RESTRICT=!test? ( test ) SLOT=0 -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 git-r3 2347f8fe2d392b2a091191f94be37e6f multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 b9fc5e97e886514e5132f50465185401 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 git-r3 2347f8fe2d392b2a091191f94be37e6f multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 25c880c1db58e21b80b684bacc964958 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=fa681690dc7c4904899bd6807e2ca434 diff --git a/metadata/md5-cache/sci-chemistry/votca-csg-1.6.4 b/metadata/md5-cache/sci-chemistry/votca-csg-1.6.4 index 7b903fee9b8b..118bfee6aafa 100644 --- a/metadata/md5-cache/sci-chemistry/votca-csg-1.6.4 +++ b/metadata/md5-cache/sci-chemistry/votca-csg-1.6.4 @@ -12,5 +12,5 @@ PDEPEND=extras? ( ~sci-chemistry/votca-csgapps-1.6.4 ) RDEPEND=app-shells/bash:* >=dev-cpp/eigen-3.3 dev-lang/perl ~sci-libs/votca-tools-1.6.4 gromacs? ( sci-chemistry/gromacs:=[gmxapi-legacy(+)] ) hdf5? ( sci-libs/hdf5 ) SLOT=0 SRC_URI=https://github.com/votca/csg/archive/v1.6.4.tar.gz -> votca-csg-1.6.4.tar.gz doc? ( https://github.com/votca/csg-manual/releases/download/v1.6.4/votca-csg-manual-1.6.4.pdf ) examples? ( https://github.com/votca/csg-tutorials/archive/v1.6.4.tar.gz -> votca-csg-tutorials-1.6.4.tar.gz ) -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=2f329cc3dd7168728e805eec9f7a32bf diff --git a/metadata/md5-cache/sci-chemistry/votca-csg-2021.2 b/metadata/md5-cache/sci-chemistry/votca-csg-2021.2 index 5a89b7b74d0d..660ab003cabc 100644 --- a/metadata/md5-cache/sci-chemistry/votca-csg-2021.2 +++ b/metadata/md5-cache/sci-chemistry/votca-csg-2021.2 @@ -12,5 +12,5 @@ RDEPEND=app-shells/bash:* >=dev-cpp/eigen-3.3 dev-lang/perl ~sci-libs/votca-tool RESTRICT=!test? ( test ) SLOT=0 SRC_URI=https://github.com/votca/csg/archive/v2021.2.tar.gz -> votca-csg-2021.2.tar.gz examples? ( https://github.com/votca/csg-tutorials/archive/v2021.2.tar.gz -> votca-csg-tutorials-2021.2.tar.gz ) -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=aa61163ebdebfc006a4183a3cbae6c68 diff --git a/metadata/md5-cache/sci-chemistry/votca-csgapps-1.6.4 b/metadata/md5-cache/sci-chemistry/votca-csgapps-1.6.4 index 2b5eee245e0a..d3f92cc9e471 100644 --- a/metadata/md5-cache/sci-chemistry/votca-csgapps-1.6.4 +++ b/metadata/md5-cache/sci-chemistry/votca-csgapps-1.6.4 @@ -10,5 +10,5 @@ LICENSE=Apache-2.0 RDEPEND=>=dev-cpp/eigen-3.3 ~sci-chemistry/votca-csg-1.6.4 SLOT=0 SRC_URI=https://github.com/votca/csgapps/archive/v1.6.4.tar.gz -> votca-csgapps-1.6.4.tar.gz -_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=cmake 44afbf15c35884f7c840470f1cf05d0d edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=05cbd3b8f122302c77953bfa3452c293 diff --git a/metadata/md5-cache/sci-chemistry/votca-xtp-1.6.4 b/metadata/md5-cache/sci-chemistry/votca-xtp-1.6.4 index 7c82ed742dce..f260d46f7da3 100644 --- a/metadata/md5-cache/sci-chemistry/votca-xtp-1.6.4 +++ b/metadata/md5-cache/sci-chemistry/votca-xtp-1.6.4 @@ -10,5 +10,5 @@ LICENSE=Apache-2.0 RDEPEND=>=dev-cpp/eigen-3.3 ~sci-chemistry/votca-csg-1.6.4 sci-libs/hdf5[cxx] sci-libs/libxc ~sci-libs/votca-tools-1.6.4 SLOT=0 SRC_URI=https://github.com/votca/xtp/archive/v1.6.4.tar.gz -> votca-xtp-1.6.4.tar.gz -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=2748df7df0e3b59bd0a842fe11ca3f68 diff --git a/metadata/md5-cache/sci-chemistry/votca-xtp-2021.2 b/metadata/md5-cache/sci-chemistry/votca-xtp-2021.2 index 3833902ef820..ace9a3855b3d 100644 --- a/metadata/md5-cache/sci-chemistry/votca-xtp-2021.2 +++ b/metadata/md5-cache/sci-chemistry/votca-xtp-2021.2 @@ -12,5 +12,5 @@ RDEPEND=>=dev-cpp/eigen-3.3 ~sci-chemistry/votca-csg-2021.2 sci-libs/hdf5[cxx] s RESTRICT=!test? ( test ) SLOT=0 SRC_URI=https://github.com/votca/xtp/archive/v2021.2.tar.gz -> votca-xtp-2021.2.tar.gz -_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 58ec4e54962bf45d065fb95030701514 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a +_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 44afbf15c35884f7c840470f1cf05d0d edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 8f942ebdcf04334697649d4a0bf65a32 flag-o-matic 29a755b1291d64133634d80b0328f153 multilib 5ca4e49abed8e3a2f7b56920eadee157 multiprocessing b4e253ab22cef7b1085e9b67c7a3b730 ninja-utils 8ed38f92fe095be374d6c4c8d4c0dda7 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs 441f754fd75cd4fd1fa06fbc17da6144 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils ac0e315a3688929e34ac75b139e7349a _md5_=8263546cfc693f6fe224a55c0a16dafd |