diff options
Diffstat (limited to 'sci-physics/lammps')
-rw-r--r-- | sci-physics/lammps/Manifest | 21 | ||||
-rw-r--r-- | sci-physics/lammps/files/1080.patch | 29 | ||||
-rw-r--r-- | sci-physics/lammps/lammps-20180117.ebuild | 132 | ||||
-rw-r--r-- | sci-physics/lammps/lammps-20180222.ebuild | 132 | ||||
-rw-r--r-- | sci-physics/lammps/lammps-20180308.ebuild | 132 | ||||
-rw-r--r-- | sci-physics/lammps/lammps-20180316.ebuild | 132 | ||||
-rw-r--r-- | sci-physics/lammps/lammps-20180822.ebuild | 131 | ||||
-rw-r--r-- | sci-physics/lammps/lammps-20181212.ebuild | 131 | ||||
-rw-r--r-- | sci-physics/lammps/lammps-20190605.ebuild | 131 | ||||
-rw-r--r-- | sci-physics/lammps/lammps-20190807-r1.ebuild | 131 | ||||
-rw-r--r-- | sci-physics/lammps/lammps-20190807.ebuild | 131 |
11 files changed, 0 insertions, 1233 deletions
diff --git a/sci-physics/lammps/Manifest b/sci-physics/lammps/Manifest index 5662e6f87741..3626d767ab7c 100644 --- a/sci-physics/lammps/Manifest +++ b/sci-physics/lammps/Manifest @@ -1,25 +1,4 @@ -AUX 1080.patch 922 BLAKE2B 59325abb5d2f9d9e501c34b539a98efea521ee38872f1e2d3850442aac82adaea3a3c32e644f3d2982aa9aa86dbdfb5bd1373175a89acffac63d87ac542919a7 SHA512 a94bba2ad992f85db0f7d7d04cef235a79e4600e353897032d78ffc3e1f899bc340a5ad8aa1d8da41f9783b67d912dab8c3cd2f83a605a9e0c0ef51bdb909279 -DIST lammps-patch_12Dec2018.tar.gz 114619148 BLAKE2B 089e23681e46868d09991ca6525850838100aa74ce8796f3af602c76b74fd55618c91610193cfc22c1201e5417f11998f924642961b62824c0271e208f87b286 SHA512 4794fc9bed7974ec33d54b2843f17b29c61a63f91f76c75bec7f00f6f174901f703130564977f8cf7fa9274e7febe096878dc0fa84d65469a5eb8f9b17b58a5e -DIST lammps-patch_16Mar2018.tar.gz 91908414 BLAKE2B 0d2363ba507765d439988be9f17390889539ecf22132145f5f5f5411c6c3bf097b278b24b005374e4b176efcfbd01edb48b55076bfa41403718ad14d3905e062 SHA512 2847f9ffa368b966cba4792ebe86ea38dfc1e147647e2b738753121a09689901cea7197d3d95fa69cd065cd1d30aa37cbeffcb78b62ec85d88cd9f3ab25e25c2 -DIST lammps-patch_17Jan2018.tar.gz 91721592 BLAKE2B d606a5fd699f3e7aaa777065532f778e96a5b21b88de3fcce69e79c4931fea233ed1ad68f56120865061623c6e33282b9f23f927a7a9820f8f824a241e5cd823 SHA512 533ada073882e9bfc6431db62c4899005983d9efbbb043bcb50b2b0a7af2b11c411bbcc6523b2ffbd5d46531b24573f4b98a07dc757bacbc2f27bb056d7956ff -DIST lammps-patch_22Aug2018.tar.gz 108761265 BLAKE2B fc509ccd8f5fda9fea9cf7f54b888df235b5d499a0aa3eee24bba81d35c95355cfc72ebb60f32a4adb879c0ab176659ebe634f9bbaeefd54ffc0d02329054f9f SHA512 bb1c11ef9c287b101b9f3483d6b90e55dc69a048529e5076f6f7d46e54802d0d75efc899865d462f9dd76937089e1080a126c1dc4bbb2648eda91cb38ba142b0 -DIST lammps-patch_22Feb2018.tar.gz 91869050 BLAKE2B 09d364b489d4402145b879ca40b290a4e33f39b6e5e4183bcccb09001002cb742917c8792f942a8b64bd992cde5c0f8dcd8b76506048f1392d33d1192aa4551d SHA512 8d4ac0f9cdcf4caa10bfb48129eec21cf31f7ce881b4cbd803c20fb638f7e55a1e645d314e172fe70eab473a4976c7f482e8c059e0c4e82527eb9438437ae146 -DIST lammps-patch_5Jun2019.tar.gz 106437193 BLAKE2B ce2a89f58fcdc29fbfc6d5e8769e36402569e93182a19835a0482b228ae9f568c1b56d2fc5eb3dac8e94a1289b430279d88c15284e07b5f62049aaf86cca29d3 SHA512 d72a5de3068a902cd8a825c97cd071331d5e3c16429531809178c43930b363f6549bd6802b552c2667e8882f7f21c90bd815072deb5ac19c8687060c796e58b4 -DIST lammps-patch_7Aug2019.tar.gz 105303933 BLAKE2B 8609251a919a88da64f2c0578414567141f128bbce3a447be09a99fb1f96620c15db29b4a312afc536f60237f3010a0753dfefa09d0bdfb3222b8f1491995c70 SHA512 61fff23c90a0f9029363cb90ff972e7e97b0f3be6a8153263b6be4f11960603af7f6c8b26a76b8bdcf25009c68a7a7fab3405a3f47b923695798a60723694001 -DIST lammps-patch_8Mar2018.tar.gz 91878683 BLAKE2B a4cf307769b1ac27c9cbe781a70f307d5275d2ccd4f6f77a2a21f00413ffa0af499577207afd23afd95ef6126071e8b779f6c52d50ff7117afb63161613c9f5b SHA512 57885d12e9e0ea9a6735cc2f7a2a8a9314dacbe9eaf5a46cb6d20fd7e2d0e8b0ebb3e24731eb750861973efe4d3cf0cf5a739cc9d51407f26bf3d556243c186f DIST lammps-stable_3Mar2020.tar.gz 126001870 BLAKE2B 35ed6ff208fd6dcc8eae50b8e0562a6a0771aa6419c0225353f648d95512ca64b22250ad4a3f9b836b9a25a6838e24e070a1d190fdc02b896dc1ed9838648f01 SHA512 6608cd9f6ea18d8acb55d611a560cb4b329043b41aca23fafd91fac0dfbde5a5286e1a6563bd16b2414bb3bf95929e3a2f270a0b023ce5ede515eb3353d56f04 -DIST lammps-testing-7869c75cac38cb8a3d2ef7747ea12ec5812f5151.tar.gz 54374284 BLAKE2B a223ef3926540660ce28fd2673667840002f6bfbbd5565deb9fb01b994085eb4d6cd24807fab49117a1b328f151d1511b7aa4d2fcdd443d20927112b83d029f0 SHA512 c996f7109d6467ae8e6a8c187485afb7c55b6dcf2b2e7003a8edd271e7f7dfe275079fbb0d680455628c8fd2eb87640284e8a92ffe095fcb398133be587af57a -DIST lammps-testing-827be7af84ca100d394ea1cf6d3bc49f6a8eef92.tar.gz 55706643 BLAKE2B 7f2753759e1048ee9af58f1b210fe42972cc40b6df3ab5495f66bcfd10f4818f6e2c4e27f759d6ca302024531849286c4709a869984bea3d385cb44412d4d668 SHA512 bfffb0501b7b254dfc2cfcd12945b14766c1addf680d1140a78116b97a2a70795244f3a5a439aaf69ae014e35c454a48e028ca8aa65179e5da5039d6f1676e02 -DIST lammps-testing-d0394a77fa2b4b2d545a73ea092cf6de7616aac8.tar.gz 55715042 BLAKE2B 326f0357b555c030f667c502fd2c2330aa588c4a1224434ef30637ad8c6be49a5b8ee58cbc525b874f665903cf21494b52403c3a53ec0898a8cf81906c614833 SHA512 4a980578ce584b5b9334b4177f4f9188f00ac50ca916ce63a4d2ef034a4fa218366a8f32cc7dc29dc99e6b01e40cf8c8bbf15566840fe07fc5c6c2e8c55ece93 DIST lammps-testing-stable_3Mar2020.tar.gz 55729550 BLAKE2B d0de8efa83342b4a350f17a43d3fe96011534b3f410beb295e396a45200ea56298c14664b290b2e30ab4f2fd70b92c01c73927b2878e8171a166dedee8ecf379 SHA512 e3dc592ce57ae625eb66ddd9ca80d7bbaca57c47a07166a7196dcc3074b574a497e706da8baf93b5deacdf588702ceb141014533ac2aaccdd011836fb34943b9 -EBUILD lammps-20180117.ebuild 3051 BLAKE2B e37e610a7a2d80271a063b746d248e2bffebc227b3fff95028770831c21798edfc1fb00985c4b6e155356dd53fe8a5f99c483ccb8eeea4a01ae791d6f7f7f44b SHA512 4abb079bc63f1048317c38912b49a9ce05755ad9dac5adc7f787f2c2e5d9748568c80847a41cb2fd8cf3dcd251187c3ab9efce89ba593fd80b45ba17d0641baf -EBUILD lammps-20180222.ebuild 3051 BLAKE2B e37e610a7a2d80271a063b746d248e2bffebc227b3fff95028770831c21798edfc1fb00985c4b6e155356dd53fe8a5f99c483ccb8eeea4a01ae791d6f7f7f44b SHA512 4abb079bc63f1048317c38912b49a9ce05755ad9dac5adc7f787f2c2e5d9748568c80847a41cb2fd8cf3dcd251187c3ab9efce89ba593fd80b45ba17d0641baf -EBUILD lammps-20180308.ebuild 3051 BLAKE2B e37e610a7a2d80271a063b746d248e2bffebc227b3fff95028770831c21798edfc1fb00985c4b6e155356dd53fe8a5f99c483ccb8eeea4a01ae791d6f7f7f44b SHA512 4abb079bc63f1048317c38912b49a9ce05755ad9dac5adc7f787f2c2e5d9748568c80847a41cb2fd8cf3dcd251187c3ab9efce89ba593fd80b45ba17d0641baf -EBUILD lammps-20180316.ebuild 3049 BLAKE2B 82781acaecd343ad423a2eb85fe609255c34244f7e10104248c69fa57dd6fa8bdc3876d17fa9facb13de21dfec4697f8b3ed59422cc27e6defa92188087906bf SHA512 3204a79cf3f72df83edb53eea1587d338510a94849ef9aa40cea3f97a34a753d11736057ce893493fed0b3a147cf940db6b5d5e9a0a96a1208d7ac08035b46c8 -EBUILD lammps-20180822.ebuild 2836 BLAKE2B fa3bf2118eab720539dcc1eb82b2d0e30e272f20ba321343927d05504e52d8a7b8688d592ed32581a90e03697d30a1ce0d94d3c8e7aa052800037f4d20932da3 SHA512 7acdf59d6d75821149e8ab1545398bd5621d664b905cb2b11f2be8771db234043efe72097d786c8d83bae59b4396d6522087312b735267b3aad3cb7c9e025bb8 -EBUILD lammps-20181212.ebuild 2977 BLAKE2B b5ea51f68299218d3d190f987786ec87b85beab0bab2e00eeba2bd2134e9d52feab21cd04679dc00b7946ab412289866409f60b32bd5f631deb9a75d150f1ecd SHA512 035e5ad6685ac59cefe8ba9bb5b5e1d4ed8a2101cf25f9a023929aaa27a48fd980394e172bbc772fcfe9da90e8a7a066087e49deb9aad2e3d71169711397323f -EBUILD lammps-20190605.ebuild 2977 BLAKE2B 345d85601ce372b0632e8fd59cdca0b5e5ba0570309e507416abf48f63c62cca8b0c34db227490ee9e372f4d8de69162a8e4c65de3eaa574fb6fc4143b23503a SHA512 66a5d8d7a39160100b67834d5dda9f2650338c5202f037ea744f1f8a543b4a9dfabce1dfec0ce8376c40b2231be637e61ba1b001fd7e7ebe70e01ebb38c96ac1 -EBUILD lammps-20190807-r1.ebuild 2981 BLAKE2B 596bbab3fd8f1fc2e9704ff4f8a1820f60315f14f5d6ef3789f73cdc65ffeb2940d65f31dea29b729cbf88a2287791ba05a3b89e6a66bc694f6f47b8958be9d6 SHA512 a0f4c13dc9522fd12b683aedf8b8b4ce4f3cf7a94db166f7958beaede73d43ba021abb0b2cb2155faf101832f101adec741cf6ee9edb84e3a52205bf1de6fee9 -EBUILD lammps-20190807.ebuild 2977 BLAKE2B a3744848fa52a8a760380bc63d96827bbff4da11f8d2a920d2564d62420373205c4e86b3fa6854a3d3b8954566a7b1b61c9a104ba0dc858b869879f3074cb9e4 SHA512 bebd28215512949a6c6f99ba187aac9ce720114272c03033cc87bb3386a40778e153da97780d57cf8ffc95bc208ad9df649f1e840b123ebb3484e87b0279bfcc EBUILD lammps-20200303.ebuild 3043 BLAKE2B adc573dde316ae1b4e0f8730a998cb4fd4100ef7543f337d255034a2e2018428209d063977f4f1726a35b68ac46232a54b55e79ebada774d6dac106017e419b9 SHA512 65e11efe60e38b668a69a84922cb7130c7ce889b42e4a22c2c0ed1275d8b1a5df72e53da34102ff5e90f5507c36f4326c2dc0b8cd657703aa866990eb3799464 MISC metadata.xml 1400 BLAKE2B 799d1c7a8a17a78af7de38cba5058ebe2b79eb577f8bcfa918459bccedecf151adc9442fe2031f16c6215b9126045a7472cb91fdf0d9a68c6f22271a5a2a5226 SHA512 8f864d325dfcbba719be7f7860485810a63a685739d0f2a0ec45989362b3eec28351d4ad34f579572f638291f2bad96ac04ca6eacd4c886ffbb77fb6d06dbe12 diff --git a/sci-physics/lammps/files/1080.patch b/sci-physics/lammps/files/1080.patch deleted file mode 100644 index 85538b2a638c..000000000000 --- a/sci-physics/lammps/files/1080.patch +++ /dev/null @@ -1,29 +0,0 @@ -From a10bb4b96f40f3b5574b0fade2cfece8bf4c6fc9 Mon Sep 17 00:00:00 2001 -From: Christoph Junghans <junghans@lanl.gov> -Date: Thu, 23 Aug 2018 15:02:36 -0600 -Subject: [PATCH] cmake: fix link issue with --as-needed - ---- - cmake/CMakeLists.txt | 5 ++++- - 1 file changed, 4 insertions(+), 1 deletion(-) - -diff --git a/cmake/CMakeLists.txt b/cmake/CMakeLists.txt -index 460d177c92..51997593db 100644 ---- a/CMakeLists.txt -+++ b/CMakeLists.txt -@@ -276,11 +276,14 @@ endif() - - if(PKG_MSCG OR PKG_USER-ATC OR PKG_USER-AWPMD OR PKG_USER-QUIP OR PKG_LATTE) - find_package(LAPACK) -- if(NOT LAPACK_FOUND) -+ find_package(BLAS) -+ if(NOT LAPACK_FOUND OR NOT BLAS_FOUND) - enable_language(Fortran) - file(GLOB LAPACK_SOURCES ${LAMMPS_LIB_SOURCE_DIR}/linalg/*.[fF]) - add_library(linalg STATIC ${LAPACK_SOURCES}) - set(LAPACK_LIBRARIES linalg) -+ else() -+ list(APPEND LAPACK_LIBRARIES ${BLAS_LIBRARIES}) - endif() - endif() - diff --git a/sci-physics/lammps/lammps-20180117.ebuild b/sci-physics/lammps/lammps-20180117.ebuild deleted file mode 100644 index 61fd0f7d4703..000000000000 --- a/sci-physics/lammps/lammps-20180117.ebuild +++ /dev/null @@ -1,132 +0,0 @@ -# Copyright 1999-2020 Gentoo Authors -# Distributed under the terms of the GNU General Public License v2 - -EAPI=6 - -PYTHON_COMPAT=( python3_6 ) - -inherit cmake-utils fortran-2 python-r1 - -convert_month() { - local months=( "" Jan Feb Mar Apr May Jun Jul Aug Sep Oct Nov Dec ) - echo ${months[${1#0}]} -} - -MY_PV="patch_$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:0:4}" -MY_P="${PN}-${MY_PV}" - -DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" -HOMEPAGE="https://lammps.sandia.gov/" -SRC_URI="https://github.com/lammps/lammps/archive/${MY_PV}.tar.gz -> ${MY_P}.tar.gz" - -LICENSE="GPL-2" -SLOT="0" -KEYWORDS="~amd64 ~x86" -IUSE="cuda examples gzip lammps-memalign mpi netcdf python test" -RESTRICT="!test? ( test )" - -DEPEND=" - app-arch/gzip - media-libs/libpng:0 - sys-libs/zlib - mpi? ( - virtual/mpi - sci-libs/hdf5[mpi] - ) - python? ( ${PYTHON_DEPS} ) - sci-libs/voro++ - virtual/blas - virtual/lapack - sci-libs/fftw:3.0 - netcdf? ( sci-libs/netcdf ) - cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1 ) - dev-cpp/eigen:3 - " -RDEPEND="${DEPEND}" - -REQUIRED_USE="python? ( ${PYTHON_REQUIRED_USE} )" - -S="${WORKDIR}/${MY_P}/cmake" - -src_configure() { - local mycmakeargs=( - -DBUILD_SHARED_LIBS=ON - -DENABLE_MPI=$(usex mpi) - -DENABLE_GPU=$(usex cuda) - -DENABLE_TESTING=$(usex test) - -DENABLE_ASPHERE=ON - -DENABLE_BODY=ON - -DENABLE_CLASS2=ON - -DENABLE_COLLOID=ON - -DENABLE_COMPRESS=ON - -DENABLE_CORESHELL=ON - -DENABLE_DIPOLE=ON - -DENABLE_GRANULAR=ON - -DENABLE_KSPACE=ON - -DFFT=FFTW3 - -DENABLE_MANYBODY=ON - -DENABLE_MC=ON - -DENABLE_MEAM=ON - -DENABLE_MISC=ON - -DLAMMPS_XDR=ON #630444 - -DENABLE_MOLECULE=ON - -DENABLE_PERI=ON - -DENABLE_QEQ=ON - -DENABLE_REAX=ON - -DENABLE_REPLICA=ON - -DENABLE_RIGID=ON - -DENABLE_SHOCK=ON - -DENABLE_SNAP=ON - -DENABLE_SRD=ON - -DENABLE_PYTHON=ON - -DENABLE_MPIIO=$(usex mpi) - -DENABLE_VORONOI=ON - -DENABLE_USER-ATC=ON - -DENABLE_USER-AWPMD=ON - -DENABLE_USER-CGDNA=ON - -DENABLE_USER-CGSDK=ON - -DENABLE_USER-COLVARS=ON - -DENABLE_USER-DIFFRACTION=ON - -DENABLE_USER-DPD=ON - -DENABLE_USER-DRUDE=ON - -DENABLE_USER-EFF=ON - -DENABLE_USER-FEP=ON - -DENABLE_USER-H5MD=$(usex mpi) - -DENABLE_USER-LB=$(usex mpi) - -DENABLE_USER-MANIFOLD=ON - -DENABLE_USER-MEAMC=ON - -DENABLE_USER-MGPT=ON - -DENABLE_USER-MISC=ON - -DENABLE_USER-MOLFILE=ON - -DENABLE_USER-NETCDF=$(usex netcdf) - -DENABLE_USER-PHONON=ON - -DENABLE_USER-QTB=ON - -DENABLE_USER-REAXC=ON - -DENABLE_USER-SMD=ON - -DENABLE_USER-SMTBQ=ON - -DENABLE_USER-SPH=ON - -DENABLE_USER-TALLY=ON - ) - cmake-utils_src_configure -} - -src_install() { - cmake-utils_src_install - - local LAMMPS_POTENTIALS="usr/share/${PN}/potentials" - insinto "/${LAMMPS_POTENTIALS}" - doins "${S}"/../potentials/* - echo "LAMMPS_POTENTIALS=${EROOT}${LAMMPS_POTENTIALS}" > 99lammps - doenvd 99lammps - - # Install python script. - use python && python_foreach_impl python_domodule "${S}"/../python/lammps.py - - if use examples; then - for d in examples bench; do - local LAMMPS_EXAMPLES="/usr/share/${PN}/${d}" - insinto "${LAMMPS_EXAMPLES}" - doins -r "${S}"/../${d}/* - done - fi -} diff --git a/sci-physics/lammps/lammps-20180222.ebuild b/sci-physics/lammps/lammps-20180222.ebuild deleted file mode 100644 index 61fd0f7d4703..000000000000 --- a/sci-physics/lammps/lammps-20180222.ebuild +++ /dev/null @@ -1,132 +0,0 @@ -# Copyright 1999-2020 Gentoo Authors -# Distributed under the terms of the GNU General Public License v2 - -EAPI=6 - -PYTHON_COMPAT=( python3_6 ) - -inherit cmake-utils fortran-2 python-r1 - -convert_month() { - local months=( "" Jan Feb Mar Apr May Jun Jul Aug Sep Oct Nov Dec ) - echo ${months[${1#0}]} -} - -MY_PV="patch_$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:0:4}" -MY_P="${PN}-${MY_PV}" - -DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" -HOMEPAGE="https://lammps.sandia.gov/" -SRC_URI="https://github.com/lammps/lammps/archive/${MY_PV}.tar.gz -> ${MY_P}.tar.gz" - -LICENSE="GPL-2" -SLOT="0" -KEYWORDS="~amd64 ~x86" -IUSE="cuda examples gzip lammps-memalign mpi netcdf python test" -RESTRICT="!test? ( test )" - -DEPEND=" - app-arch/gzip - media-libs/libpng:0 - sys-libs/zlib - mpi? ( - virtual/mpi - sci-libs/hdf5[mpi] - ) - python? ( ${PYTHON_DEPS} ) - sci-libs/voro++ - virtual/blas - virtual/lapack - sci-libs/fftw:3.0 - netcdf? ( sci-libs/netcdf ) - cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1 ) - dev-cpp/eigen:3 - " -RDEPEND="${DEPEND}" - -REQUIRED_USE="python? ( ${PYTHON_REQUIRED_USE} )" - -S="${WORKDIR}/${MY_P}/cmake" - -src_configure() { - local mycmakeargs=( - -DBUILD_SHARED_LIBS=ON - -DENABLE_MPI=$(usex mpi) - -DENABLE_GPU=$(usex cuda) - -DENABLE_TESTING=$(usex test) - -DENABLE_ASPHERE=ON - -DENABLE_BODY=ON - -DENABLE_CLASS2=ON - -DENABLE_COLLOID=ON - -DENABLE_COMPRESS=ON - -DENABLE_CORESHELL=ON - -DENABLE_DIPOLE=ON - -DENABLE_GRANULAR=ON - -DENABLE_KSPACE=ON - -DFFT=FFTW3 - -DENABLE_MANYBODY=ON - -DENABLE_MC=ON - -DENABLE_MEAM=ON - -DENABLE_MISC=ON - -DLAMMPS_XDR=ON #630444 - -DENABLE_MOLECULE=ON - -DENABLE_PERI=ON - -DENABLE_QEQ=ON - -DENABLE_REAX=ON - -DENABLE_REPLICA=ON - -DENABLE_RIGID=ON - -DENABLE_SHOCK=ON - -DENABLE_SNAP=ON - -DENABLE_SRD=ON - -DENABLE_PYTHON=ON - -DENABLE_MPIIO=$(usex mpi) - -DENABLE_VORONOI=ON - -DENABLE_USER-ATC=ON - -DENABLE_USER-AWPMD=ON - -DENABLE_USER-CGDNA=ON - -DENABLE_USER-CGSDK=ON - -DENABLE_USER-COLVARS=ON - -DENABLE_USER-DIFFRACTION=ON - -DENABLE_USER-DPD=ON - -DENABLE_USER-DRUDE=ON - -DENABLE_USER-EFF=ON - -DENABLE_USER-FEP=ON - -DENABLE_USER-H5MD=$(usex mpi) - -DENABLE_USER-LB=$(usex mpi) - -DENABLE_USER-MANIFOLD=ON - -DENABLE_USER-MEAMC=ON - -DENABLE_USER-MGPT=ON - -DENABLE_USER-MISC=ON - -DENABLE_USER-MOLFILE=ON - -DENABLE_USER-NETCDF=$(usex netcdf) - -DENABLE_USER-PHONON=ON - -DENABLE_USER-QTB=ON - -DENABLE_USER-REAXC=ON - -DENABLE_USER-SMD=ON - -DENABLE_USER-SMTBQ=ON - -DENABLE_USER-SPH=ON - -DENABLE_USER-TALLY=ON - ) - cmake-utils_src_configure -} - -src_install() { - cmake-utils_src_install - - local LAMMPS_POTENTIALS="usr/share/${PN}/potentials" - insinto "/${LAMMPS_POTENTIALS}" - doins "${S}"/../potentials/* - echo "LAMMPS_POTENTIALS=${EROOT}${LAMMPS_POTENTIALS}" > 99lammps - doenvd 99lammps - - # Install python script. - use python && python_foreach_impl python_domodule "${S}"/../python/lammps.py - - if use examples; then - for d in examples bench; do - local LAMMPS_EXAMPLES="/usr/share/${PN}/${d}" - insinto "${LAMMPS_EXAMPLES}" - doins -r "${S}"/../${d}/* - done - fi -} diff --git a/sci-physics/lammps/lammps-20180308.ebuild b/sci-physics/lammps/lammps-20180308.ebuild deleted file mode 100644 index 61fd0f7d4703..000000000000 --- a/sci-physics/lammps/lammps-20180308.ebuild +++ /dev/null @@ -1,132 +0,0 @@ -# Copyright 1999-2020 Gentoo Authors -# Distributed under the terms of the GNU General Public License v2 - -EAPI=6 - -PYTHON_COMPAT=( python3_6 ) - -inherit cmake-utils fortran-2 python-r1 - -convert_month() { - local months=( "" Jan Feb Mar Apr May Jun Jul Aug Sep Oct Nov Dec ) - echo ${months[${1#0}]} -} - -MY_PV="patch_$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:0:4}" -MY_P="${PN}-${MY_PV}" - -DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" -HOMEPAGE="https://lammps.sandia.gov/" -SRC_URI="https://github.com/lammps/lammps/archive/${MY_PV}.tar.gz -> ${MY_P}.tar.gz" - -LICENSE="GPL-2" -SLOT="0" -KEYWORDS="~amd64 ~x86" -IUSE="cuda examples gzip lammps-memalign mpi netcdf python test" -RESTRICT="!test? ( test )" - -DEPEND=" - app-arch/gzip - media-libs/libpng:0 - sys-libs/zlib - mpi? ( - virtual/mpi - sci-libs/hdf5[mpi] - ) - python? ( ${PYTHON_DEPS} ) - sci-libs/voro++ - virtual/blas - virtual/lapack - sci-libs/fftw:3.0 - netcdf? ( sci-libs/netcdf ) - cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1 ) - dev-cpp/eigen:3 - " -RDEPEND="${DEPEND}" - -REQUIRED_USE="python? ( ${PYTHON_REQUIRED_USE} )" - -S="${WORKDIR}/${MY_P}/cmake" - -src_configure() { - local mycmakeargs=( - -DBUILD_SHARED_LIBS=ON - -DENABLE_MPI=$(usex mpi) - -DENABLE_GPU=$(usex cuda) - -DENABLE_TESTING=$(usex test) - -DENABLE_ASPHERE=ON - -DENABLE_BODY=ON - -DENABLE_CLASS2=ON - -DENABLE_COLLOID=ON - -DENABLE_COMPRESS=ON - -DENABLE_CORESHELL=ON - -DENABLE_DIPOLE=ON - -DENABLE_GRANULAR=ON - -DENABLE_KSPACE=ON - -DFFT=FFTW3 - -DENABLE_MANYBODY=ON - -DENABLE_MC=ON - -DENABLE_MEAM=ON - -DENABLE_MISC=ON - -DLAMMPS_XDR=ON #630444 - -DENABLE_MOLECULE=ON - -DENABLE_PERI=ON - -DENABLE_QEQ=ON - -DENABLE_REAX=ON - -DENABLE_REPLICA=ON - -DENABLE_RIGID=ON - -DENABLE_SHOCK=ON - -DENABLE_SNAP=ON - -DENABLE_SRD=ON - -DENABLE_PYTHON=ON - -DENABLE_MPIIO=$(usex mpi) - -DENABLE_VORONOI=ON - -DENABLE_USER-ATC=ON - -DENABLE_USER-AWPMD=ON - -DENABLE_USER-CGDNA=ON - -DENABLE_USER-CGSDK=ON - -DENABLE_USER-COLVARS=ON - -DENABLE_USER-DIFFRACTION=ON - -DENABLE_USER-DPD=ON - -DENABLE_USER-DRUDE=ON - -DENABLE_USER-EFF=ON - -DENABLE_USER-FEP=ON - -DENABLE_USER-H5MD=$(usex mpi) - -DENABLE_USER-LB=$(usex mpi) - -DENABLE_USER-MANIFOLD=ON - -DENABLE_USER-MEAMC=ON - -DENABLE_USER-MGPT=ON - -DENABLE_USER-MISC=ON - -DENABLE_USER-MOLFILE=ON - -DENABLE_USER-NETCDF=$(usex netcdf) - -DENABLE_USER-PHONON=ON - -DENABLE_USER-QTB=ON - -DENABLE_USER-REAXC=ON - -DENABLE_USER-SMD=ON - -DENABLE_USER-SMTBQ=ON - -DENABLE_USER-SPH=ON - -DENABLE_USER-TALLY=ON - ) - cmake-utils_src_configure -} - -src_install() { - cmake-utils_src_install - - local LAMMPS_POTENTIALS="usr/share/${PN}/potentials" - insinto "/${LAMMPS_POTENTIALS}" - doins "${S}"/../potentials/* - echo "LAMMPS_POTENTIALS=${EROOT}${LAMMPS_POTENTIALS}" > 99lammps - doenvd 99lammps - - # Install python script. - use python && python_foreach_impl python_domodule "${S}"/../python/lammps.py - - if use examples; then - for d in examples bench; do - local LAMMPS_EXAMPLES="/usr/share/${PN}/${d}" - insinto "${LAMMPS_EXAMPLES}" - doins -r "${S}"/../${d}/* - done - fi -} diff --git a/sci-physics/lammps/lammps-20180316.ebuild b/sci-physics/lammps/lammps-20180316.ebuild deleted file mode 100644 index 81370f4910c0..000000000000 --- a/sci-physics/lammps/lammps-20180316.ebuild +++ /dev/null @@ -1,132 +0,0 @@ -# Copyright 1999-2020 Gentoo Authors -# Distributed under the terms of the GNU General Public License v2 - -EAPI=6 - -PYTHON_COMPAT=( python3_6 ) - -inherit cmake-utils fortran-2 python-r1 - -convert_month() { - local months=( "" Jan Feb Mar Apr May Jun Jul Aug Sep Oct Nov Dec ) - echo ${months[${1#0}]} -} - -MY_PV="patch_$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:0:4}" -MY_P="${PN}-${MY_PV}" - -DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" -HOMEPAGE="https://lammps.sandia.gov/" -SRC_URI="https://github.com/lammps/lammps/archive/${MY_PV}.tar.gz -> ${MY_P}.tar.gz" - -LICENSE="GPL-2" -SLOT="0" -KEYWORDS="amd64 x86" -IUSE="cuda examples gzip lammps-memalign mpi netcdf python test" -RESTRICT="!test? ( test )" - -DEPEND=" - app-arch/gzip - media-libs/libpng:0 - sys-libs/zlib - mpi? ( - virtual/mpi - sci-libs/hdf5[mpi] - ) - python? ( ${PYTHON_DEPS} ) - sci-libs/voro++ - virtual/blas - virtual/lapack - sci-libs/fftw:3.0 - netcdf? ( sci-libs/netcdf ) - cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1 ) - dev-cpp/eigen:3 - " -RDEPEND="${DEPEND}" - -REQUIRED_USE="python? ( ${PYTHON_REQUIRED_USE} )" - -S="${WORKDIR}/${MY_P}/cmake" - -src_configure() { - local mycmakeargs=( - -DBUILD_SHARED_LIBS=ON - -DENABLE_MPI=$(usex mpi) - -DENABLE_GPU=$(usex cuda) - -DENABLE_TESTING=$(usex test) - -DENABLE_ASPHERE=ON - -DENABLE_BODY=ON - -DENABLE_CLASS2=ON - -DENABLE_COLLOID=ON - -DENABLE_COMPRESS=ON - -DENABLE_CORESHELL=ON - -DENABLE_DIPOLE=ON - -DENABLE_GRANULAR=ON - -DENABLE_KSPACE=ON - -DFFT=FFTW3 - -DENABLE_MANYBODY=ON - -DENABLE_MC=ON - -DENABLE_MEAM=ON - -DENABLE_MISC=ON - -DLAMMPS_XDR=ON #630444 - -DENABLE_MOLECULE=ON - -DENABLE_PERI=ON - -DENABLE_QEQ=ON - -DENABLE_REAX=ON - -DENABLE_REPLICA=ON - -DENABLE_RIGID=ON - -DENABLE_SHOCK=ON - -DENABLE_SNAP=ON - -DENABLE_SRD=ON - -DENABLE_PYTHON=ON - -DENABLE_MPIIO=$(usex mpi) - -DENABLE_VORONOI=ON - -DENABLE_USER-ATC=ON - -DENABLE_USER-AWPMD=ON - -DENABLE_USER-CGDNA=ON - -DENABLE_USER-CGSDK=ON - -DENABLE_USER-COLVARS=ON - -DENABLE_USER-DIFFRACTION=ON - -DENABLE_USER-DPD=ON - -DENABLE_USER-DRUDE=ON - -DENABLE_USER-EFF=ON - -DENABLE_USER-FEP=ON - -DENABLE_USER-H5MD=$(usex mpi) - -DENABLE_USER-LB=$(usex mpi) - -DENABLE_USER-MANIFOLD=ON - -DENABLE_USER-MEAMC=ON - -DENABLE_USER-MGPT=ON - -DENABLE_USER-MISC=ON - -DENABLE_USER-MOLFILE=ON - -DENABLE_USER-NETCDF=$(usex netcdf) - -DENABLE_USER-PHONON=ON - -DENABLE_USER-QTB=ON - -DENABLE_USER-REAXC=ON - -DENABLE_USER-SMD=ON - -DENABLE_USER-SMTBQ=ON - -DENABLE_USER-SPH=ON - -DENABLE_USER-TALLY=ON - ) - cmake-utils_src_configure -} - -src_install() { - cmake-utils_src_install - - local LAMMPS_POTENTIALS="usr/share/${PN}/potentials" - insinto "/${LAMMPS_POTENTIALS}" - doins "${S}"/../potentials/* - echo "LAMMPS_POTENTIALS=${EROOT}${LAMMPS_POTENTIALS}" > 99lammps - doenvd 99lammps - - # Install python script. - use python && python_foreach_impl python_domodule "${S}"/../python/lammps.py - - if use examples; then - for d in examples bench; do - local LAMMPS_EXAMPLES="/usr/share/${PN}/${d}" - insinto "${LAMMPS_EXAMPLES}" - doins -r "${S}"/../${d}/* - done - fi -} diff --git a/sci-physics/lammps/lammps-20180822.ebuild b/sci-physics/lammps/lammps-20180822.ebuild deleted file mode 100644 index 7cb2d7463222..000000000000 --- a/sci-physics/lammps/lammps-20180822.ebuild +++ /dev/null @@ -1,131 +0,0 @@ -# Copyright 1999-2020 Gentoo Authors -# Distributed under the terms of the GNU General Public License v2 - -EAPI=6 - -PYTHON_COMPAT=( python3_6 ) - -inherit cmake-utils fortran-2 python-r1 - -convert_month() { - local months=( "" Jan Feb Mar Apr May Jun Jul Aug Sep Oct Nov Dec ) - echo ${months[${1#0}]} -} - -MY_PV="patch_$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:0:4}" -MY_P="${PN}-${MY_PV}" - -DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" -HOMEPAGE="https://lammps.sandia.gov/" -SRC_URI="https://github.com/lammps/lammps/archive/${MY_PV}.tar.gz -> ${MY_P}.tar.gz" - -LICENSE="GPL-2" -SLOT="0" -KEYWORDS="~amd64 ~x86" -IUSE="cuda examples gzip lammps-memalign mpi netcdf python test" -RESTRICT="!test? ( test )" - -DEPEND=" - app-arch/gzip - media-libs/libpng:0 - sys-libs/zlib - mpi? ( - virtual/mpi - sci-libs/hdf5[mpi] - ) - python? ( ${PYTHON_DEPS} ) - sci-libs/voro++ - virtual/blas - virtual/lapack - sci-libs/fftw:3.0 - netcdf? ( sci-libs/netcdf ) - cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1 ) - dev-cpp/eigen:3 - " -RDEPEND="${DEPEND}" - -REQUIRED_USE="python? ( ${PYTHON_REQUIRED_USE} )" - -# https://github.com/lammps/lammps/pull/1080 -PATCHES=( "${FILESDIR}/1080.patch" ) - -S="${WORKDIR}/${MY_P}/cmake" - -src_configure() { - local mycmakeargs=( - -DCMAKE_INSTALL_SYSCONFDIR="${EPREFIX}/etc" - -DBUILD_SHARED_LIBS=ON - -DBUILD_MPI=$(usex mpi) - -DBUILD_LIB=ON - -DPKG_GPU=$(usex cuda) - -DGPU_API=CUDA - -DENABLE_TESTING=$(usex test) - -DPKG_ASPHERE=ON - -DPKG_BODY=ON - -DPKG_CLASS2=ON - -DPKG_COLLOID=ON - -DPKG_COMPRESS=ON - -DPKG_CORESHELL=ON - -DPKG_DIPOLE=ON - -DPKG_GRANULAR=ON - -DPKG_KSPACE=ON - -DFFT=FFTW3 - -DPKG_MANYBODY=ON - -DPKG_MC=ON - -DPKG_MEAM=ON - -DPKG_MISC=ON - -DPKG_MOLECULE=ON - -DPKG_PERI=ON - -DPKG_QEQ=ON - -DPKG_REAX=ON - -DPKG_REPLICA=ON - -DPKG_RIGID=ON - -DPKG_SHOCK=ON - -DPKG_SNAP=ON - -DPKG_SRD=ON - -DPKG_PYTHON=ON - -DPKG_MPIIO=$(usex mpi) - -DPKG_VORONOI=ON - -DPKG_USER-ATC=ON - -DPKG_USER-AWPMD=ON - -DPKG_USER-CGDNA=ON - -DPKG_USER-CGSDK=ON - -DPKG_USER-COLVARS=ON - -DPKG_USER-DIFFRACTION=ON - -DPKG_USER-DPD=ON - -DPKG_USER-DRUDE=ON - -DPKG_USER-EFF=ON - -DPKG_USER-FEP=ON - -DPKG_USER-H5MD=$(usex mpi) - -DPKG_USER-LB=$(usex mpi) - -DPKG_USER-MANIFOLD=ON - -DPKG_USER-MEAMC=ON - -DPKG_USER-MGPT=ON - -DPKG_USER-MISC=ON - -DPKG_USER-MOLFILE=ON - -DPKG_USER-NETCDF=$(usex netcdf) - -DPKG_USER-PHONON=ON - -DPKG_USER-QTB=ON - -DPKG_USER-REAXC=ON - -DPKG_USER-SMD=ON - -DPKG_USER-SMTBQ=ON - -DPKG_USER-SPH=ON - -DPKG_USER-TALLY=ON - ) - cmake-utils_src_configure -} - -src_install() { - cmake-utils_src_install - - # Install python script. - use python && python_foreach_impl python_domodule "${S}"/../python/lammps.py - - if use examples; then - for d in examples bench; do - local LAMMPS_EXAMPLES="/usr/share/${PN}/${d}" - insinto "${LAMMPS_EXAMPLES}" - doins -r "${S}"/../${d}/* - done - fi -} diff --git a/sci-physics/lammps/lammps-20181212.ebuild b/sci-physics/lammps/lammps-20181212.ebuild deleted file mode 100644 index b63164986725..000000000000 --- a/sci-physics/lammps/lammps-20181212.ebuild +++ /dev/null @@ -1,131 +0,0 @@ -# Copyright 1999-2020 Gentoo Authors -# Distributed under the terms of the GNU General Public License v2 - -EAPI=6 - -PYTHON_COMPAT=( python3_6 ) - -inherit cmake-utils fortran-2 python-r1 - -convert_month() { - local months=( "" Jan Feb Mar Apr May Jun Jul Aug Sep Oct Nov Dec ) - echo ${months[${1#0}]} -} - -MY_PV="patch_$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:0:4}" -MY_P="${PN}-${MY_PV}" - -DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" -HOMEPAGE="https://lammps.sandia.gov/" -TCOMMIT=7869c75cac38cb8a3d2ef7747ea12ec5812f5151 -SRC_URI="https://github.com/lammps/lammps/archive/${MY_PV}.tar.gz -> ${MY_P}.tar.gz - test? ( https://github.com/lammps/lammps-testing/archive/${TCOMMIT}.tar.gz -> ${PN}-testing-${TCOMMIT}.tar.gz )" - -LICENSE="GPL-2" -SLOT="0" -KEYWORDS="~amd64 ~x86" -IUSE="cuda examples gzip lammps-memalign mpi netcdf python test" -RESTRICT="!test? ( test )" - -DEPEND=" - app-arch/gzip - media-libs/libpng:0 - sys-libs/zlib - mpi? ( - virtual/mpi - sci-libs/hdf5[mpi] - ) - python? ( ${PYTHON_DEPS} ) - sci-libs/voro++ - virtual/blas - virtual/lapack - sci-libs/fftw:3.0 - netcdf? ( sci-libs/netcdf ) - cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1 ) - dev-cpp/eigen:3 - " -RDEPEND="${DEPEND}" - -REQUIRED_USE="python? ( ${PYTHON_REQUIRED_USE} )" - -S="${WORKDIR}/${MY_P}/cmake" - -src_configure() { - local mycmakeargs=( - -DCMAKE_INSTALL_SYSCONFDIR="${EPREFIX}/etc" - -DBUILD_SHARED_LIBS=ON - -DBUILD_MPI=$(usex mpi) - -DBUILD_LIB=ON - -DPKG_GPU=$(usex cuda) - -DGPU_API=CUDA - -DENABLE_TESTING=$(usex test) - -DLAMMPS_TESTING_SOURCE_DIR=$(echo "${WORKDIR}"/lammps-testing-*) - -DPKG_ASPHERE=ON - -DPKG_BODY=ON - -DPKG_CLASS2=ON - -DPKG_COLLOID=ON - -DPKG_COMPRESS=ON - -DPKG_CORESHELL=ON - -DPKG_DIPOLE=ON - -DPKG_GRANULAR=ON - -DPKG_KSPACE=ON - -DFFT=FFTW3 - -DPKG_MANYBODY=ON - -DPKG_MC=ON - -DPKG_MEAM=ON - -DPKG_MISC=ON - -DPKG_MOLECULE=ON - -DPKG_PERI=ON - -DPKG_QEQ=ON - -DPKG_REAX=ON - -DPKG_REPLICA=ON - -DPKG_RIGID=ON - -DPKG_SHOCK=ON - -DPKG_SNAP=ON - -DPKG_SRD=ON - -DPKG_PYTHON=ON - -DPKG_MPIIO=$(usex mpi) - -DPKG_VORONOI=ON - -DPKG_USER-ATC=ON - -DPKG_USER-AWPMD=ON - -DPKG_USER-CGDNA=ON - -DPKG_USER-CGSDK=ON - -DPKG_USER-COLVARS=ON - -DPKG_USER-DIFFRACTION=ON - -DPKG_USER-DPD=ON - -DPKG_USER-DRUDE=ON - -DPKG_USER-EFF=ON - -DPKG_USER-FEP=ON - -DPKG_USER-H5MD=$(usex mpi) - -DPKG_USER-LB=$(usex mpi) - -DPKG_USER-MANIFOLD=ON - -DPKG_USER-MEAMC=ON - -DPKG_USER-MGPT=ON - -DPKG_USER-MISC=ON - -DPKG_USER-MOLFILE=ON - -DPKG_USER-NETCDF=$(usex netcdf) - -DPKG_USER-PHONON=ON - -DPKG_USER-QTB=ON - -DPKG_USER-REAXC=ON - -DPKG_USER-SMD=ON - -DPKG_USER-SMTBQ=ON - -DPKG_USER-SPH=ON - -DPKG_USER-TALLY=ON - ) - cmake-utils_src_configure -} - -src_install() { - cmake-utils_src_install - - # Install python script. - use python && python_foreach_impl python_domodule "${S}"/../python/lammps.py - - if use examples; then - for d in examples bench; do - local LAMMPS_EXAMPLES="/usr/share/${PN}/${d}" - insinto "${LAMMPS_EXAMPLES}" - doins -r "${S}"/../${d}/* - done - fi -} diff --git a/sci-physics/lammps/lammps-20190605.ebuild b/sci-physics/lammps/lammps-20190605.ebuild deleted file mode 100644 index c09f35787c0f..000000000000 --- a/sci-physics/lammps/lammps-20190605.ebuild +++ /dev/null @@ -1,131 +0,0 @@ -# Copyright 1999-2020 Gentoo Authors -# Distributed under the terms of the GNU General Public License v2 - -EAPI=6 - -PYTHON_COMPAT=( python3_6 ) - -inherit cmake-utils fortran-2 python-r1 - -convert_month() { - local months=( "" Jan Feb Mar Apr May Jun Jul Aug Sep Oct Nov Dec ) - echo ${months[${1#0}]} -} - -MY_PV="patch_$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:0:4}" -MY_P="${PN}-${MY_PV}" - -DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" -HOMEPAGE="https://lammps.sandia.gov/" -TCOMMIT=827be7af84ca100d394ea1cf6d3bc49f6a8eef92 -SRC_URI="https://github.com/lammps/lammps/archive/${MY_PV}.tar.gz -> ${MY_P}.tar.gz - test? ( https://github.com/lammps/lammps-testing/archive/${TCOMMIT}.tar.gz -> ${PN}-testing-${TCOMMIT}.tar.gz )" - -LICENSE="GPL-2" -SLOT="0" -KEYWORDS="~amd64 ~x86" -IUSE="cuda examples gzip lammps-memalign mpi netcdf python test" -RESTRICT="!test? ( test )" - -DEPEND=" - app-arch/gzip - media-libs/libpng:0 - sys-libs/zlib - mpi? ( - virtual/mpi - sci-libs/hdf5[mpi] - ) - python? ( ${PYTHON_DEPS} ) - sci-libs/voro++ - virtual/blas - virtual/lapack - sci-libs/fftw:3.0 - netcdf? ( sci-libs/netcdf ) - cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1 ) - dev-cpp/eigen:3 - " -RDEPEND="${DEPEND}" - -REQUIRED_USE="python? ( ${PYTHON_REQUIRED_USE} )" - -S="${WORKDIR}/${MY_P}/cmake" - -src_configure() { - local mycmakeargs=( - -DCMAKE_INSTALL_SYSCONFDIR="${EPREFIX}/etc" - -DBUILD_SHARED_LIBS=ON - -DBUILD_MPI=$(usex mpi) - -DBUILD_LIB=ON - -DPKG_GPU=$(usex cuda) - -DGPU_API=CUDA - -DENABLE_TESTING=$(usex test) - -DLAMMPS_TESTING_SOURCE_DIR=$(echo "${WORKDIR}"/lammps-testing-*) - -DPKG_ASPHERE=ON - -DPKG_BODY=ON - -DPKG_CLASS2=ON - -DPKG_COLLOID=ON - -DPKG_COMPRESS=ON - -DPKG_CORESHELL=ON - -DPKG_DIPOLE=ON - -DPKG_GRANULAR=ON - -DPKG_KSPACE=ON - -DFFT=FFTW3 - -DPKG_MANYBODY=ON - -DPKG_MC=ON - -DPKG_MEAM=ON - -DPKG_MISC=ON - -DPKG_MOLECULE=ON - -DPKG_PERI=ON - -DPKG_QEQ=ON - -DPKG_REAX=ON - -DPKG_REPLICA=ON - -DPKG_RIGID=ON - -DPKG_SHOCK=ON - -DPKG_SNAP=ON - -DPKG_SRD=ON - -DPKG_PYTHON=ON - -DPKG_MPIIO=$(usex mpi) - -DPKG_VORONOI=ON - -DPKG_USER-ATC=ON - -DPKG_USER-AWPMD=ON - -DPKG_USER-CGDNA=ON - -DPKG_USER-CGSDK=ON - -DPKG_USER-COLVARS=ON - -DPKG_USER-DIFFRACTION=ON - -DPKG_USER-DPD=ON - -DPKG_USER-DRUDE=ON - -DPKG_USER-EFF=ON - -DPKG_USER-FEP=ON - -DPKG_USER-H5MD=$(usex mpi) - -DPKG_USER-LB=$(usex mpi) - -DPKG_USER-MANIFOLD=ON - -DPKG_USER-MEAMC=ON - -DPKG_USER-MGPT=ON - -DPKG_USER-MISC=ON - -DPKG_USER-MOLFILE=ON - -DPKG_USER-NETCDF=$(usex netcdf) - -DPKG_USER-PHONON=ON - -DPKG_USER-QTB=ON - -DPKG_USER-REAXC=ON - -DPKG_USER-SMD=ON - -DPKG_USER-SMTBQ=ON - -DPKG_USER-SPH=ON - -DPKG_USER-TALLY=ON - ) - cmake-utils_src_configure -} - -src_install() { - cmake-utils_src_install - - # Install python script. - use python && python_foreach_impl python_domodule "${S}"/../python/lammps.py - - if use examples; then - for d in examples bench; do - local LAMMPS_EXAMPLES="/usr/share/${PN}/${d}" - insinto "${LAMMPS_EXAMPLES}" - doins -r "${S}"/../${d}/* - done - fi -} diff --git a/sci-physics/lammps/lammps-20190807-r1.ebuild b/sci-physics/lammps/lammps-20190807-r1.ebuild deleted file mode 100644 index b1341c65e68e..000000000000 --- a/sci-physics/lammps/lammps-20190807-r1.ebuild +++ /dev/null @@ -1,131 +0,0 @@ -# Copyright 1999-2020 Gentoo Authors -# Distributed under the terms of the GNU General Public License v2 - -EAPI=6 - -PYTHON_COMPAT=( python3_{6,7} ) - -inherit cmake-utils fortran-2 python-r1 - -convert_month() { - local months=( "" Jan Feb Mar Apr May Jun Jul Aug Sep Oct Nov Dec ) - echo ${months[${1#0}]} -} - -MY_PV="patch_$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:0:4}" -MY_P="${PN}-${MY_PV}" - -DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" -HOMEPAGE="https://lammps.sandia.gov/" -TCOMMIT=d0394a77fa2b4b2d545a73ea092cf6de7616aac8 -SRC_URI="https://github.com/lammps/lammps/archive/${MY_PV}.tar.gz -> ${MY_P}.tar.gz - test? ( https://github.com/lammps/lammps-testing/archive/${TCOMMIT}.tar.gz -> ${PN}-testing-${TCOMMIT}.tar.gz )" - -LICENSE="GPL-2" -SLOT="0" -KEYWORDS="~amd64 ~x86" -IUSE="cuda examples gzip lammps-memalign mpi netcdf python test" -RESTRICT="!test? ( test )" - -DEPEND=" - app-arch/gzip - media-libs/libpng:0 - sys-libs/zlib - mpi? ( - virtual/mpi - sci-libs/hdf5[mpi] - ) - python? ( ${PYTHON_DEPS} ) - sci-libs/voro++ - virtual/blas - virtual/lapack - sci-libs/fftw:3.0 - netcdf? ( sci-libs/netcdf ) - cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1 ) - dev-cpp/eigen:3 - " -RDEPEND="${DEPEND}" - -REQUIRED_USE="python? ( ${PYTHON_REQUIRED_USE} )" - -S="${WORKDIR}/${MY_P}/cmake" - -src_configure() { - local mycmakeargs=( - -DCMAKE_INSTALL_SYSCONFDIR="${EPREFIX}/etc" - -DBUILD_SHARED_LIBS=ON - -DBUILD_MPI=$(usex mpi) - -DBUILD_LIB=ON - -DPKG_GPU=$(usex cuda) - -DGPU_API=CUDA - -DENABLE_TESTING=$(usex test) - -DLAMMPS_TESTING_SOURCE_DIR=$(echo "${WORKDIR}"/lammps-testing-*) - -DPKG_ASPHERE=ON - -DPKG_BODY=ON - -DPKG_CLASS2=ON - -DPKG_COLLOID=ON - -DPKG_COMPRESS=ON - -DPKG_CORESHELL=ON - -DPKG_DIPOLE=ON - -DPKG_GRANULAR=ON - -DPKG_KSPACE=ON - -DFFT=FFTW3 - -DPKG_MANYBODY=ON - -DPKG_MC=ON - -DPKG_MEAM=ON - -DPKG_MISC=ON - -DPKG_MOLECULE=ON - -DPKG_PERI=ON - -DPKG_QEQ=ON - -DPKG_REAX=ON - -DPKG_REPLICA=ON - -DPKG_RIGID=ON - -DPKG_SHOCK=ON - -DPKG_SNAP=ON - -DPKG_SRD=ON - -DPKG_PYTHON=ON - -DPKG_MPIIO=$(usex mpi) - -DPKG_VORONOI=ON - -DPKG_USER-ATC=ON - -DPKG_USER-AWPMD=ON - -DPKG_USER-CGDNA=ON - -DPKG_USER-CGSDK=ON - -DPKG_USER-COLVARS=ON - -DPKG_USER-DIFFRACTION=ON - -DPKG_USER-DPD=ON - -DPKG_USER-DRUDE=ON - -DPKG_USER-EFF=ON - -DPKG_USER-FEP=ON - -DPKG_USER-H5MD=$(usex mpi) - -DPKG_USER-LB=$(usex mpi) - -DPKG_USER-MANIFOLD=ON - -DPKG_USER-MEAMC=ON - -DPKG_USER-MGPT=ON - -DPKG_USER-MISC=ON - -DPKG_USER-MOLFILE=ON - -DPKG_USER-NETCDF=$(usex netcdf) - -DPKG_USER-PHONON=ON - -DPKG_USER-QTB=ON - -DPKG_USER-REAXC=ON - -DPKG_USER-SMD=ON - -DPKG_USER-SMTBQ=ON - -DPKG_USER-SPH=ON - -DPKG_USER-TALLY=ON - ) - cmake-utils_src_configure -} - -src_install() { - cmake-utils_src_install - - # Install python script. - use python && python_foreach_impl python_domodule "${S}"/../python/lammps.py - - if use examples; then - for d in examples bench; do - local LAMMPS_EXAMPLES="/usr/share/${PN}/${d}" - insinto "${LAMMPS_EXAMPLES}" - doins -r "${S}"/../${d}/* - done - fi -} diff --git a/sci-physics/lammps/lammps-20190807.ebuild b/sci-physics/lammps/lammps-20190807.ebuild deleted file mode 100644 index 1b0598ab8f6a..000000000000 --- a/sci-physics/lammps/lammps-20190807.ebuild +++ /dev/null @@ -1,131 +0,0 @@ -# Copyright 1999-2020 Gentoo Authors -# Distributed under the terms of the GNU General Public License v2 - -EAPI=6 - -PYTHON_COMPAT=( python3_6 ) - -inherit cmake-utils fortran-2 python-r1 - -convert_month() { - local months=( "" Jan Feb Mar Apr May Jun Jul Aug Sep Oct Nov Dec ) - echo ${months[${1#0}]} -} - -MY_PV="patch_$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:0:4}" -MY_P="${PN}-${MY_PV}" - -DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" -HOMEPAGE="https://lammps.sandia.gov/" -TCOMMIT=d0394a77fa2b4b2d545a73ea092cf6de7616aac8 -SRC_URI="https://github.com/lammps/lammps/archive/${MY_PV}.tar.gz -> ${MY_P}.tar.gz - test? ( https://github.com/lammps/lammps-testing/archive/${TCOMMIT}.tar.gz -> ${PN}-testing-${TCOMMIT}.tar.gz )" - -LICENSE="GPL-2" -SLOT="0" -KEYWORDS="~amd64 ~x86" -IUSE="cuda examples gzip lammps-memalign mpi netcdf python test" -RESTRICT="!test? ( test )" - -DEPEND=" - app-arch/gzip - media-libs/libpng:0 - sys-libs/zlib - mpi? ( - virtual/mpi - sci-libs/hdf5[mpi] - ) - python? ( ${PYTHON_DEPS} ) - sci-libs/voro++ - virtual/blas - virtual/lapack - sci-libs/fftw:3.0 - netcdf? ( sci-libs/netcdf ) - cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1 ) - dev-cpp/eigen:3 - " -RDEPEND="${DEPEND}" - -REQUIRED_USE="python? ( ${PYTHON_REQUIRED_USE} )" - -S="${WORKDIR}/${MY_P}/cmake" - -src_configure() { - local mycmakeargs=( - -DCMAKE_INSTALL_SYSCONFDIR="${EPREFIX}/etc" - -DBUILD_SHARED_LIBS=ON - -DBUILD_MPI=$(usex mpi) - -DBUILD_LIB=ON - -DPKG_GPU=$(usex cuda) - -DGPU_API=CUDA - -DENABLE_TESTING=$(usex test) - -DLAMMPS_TESTING_SOURCE_DIR=$(echo "${WORKDIR}"/lammps-testing-*) - -DPKG_ASPHERE=ON - -DPKG_BODY=ON - -DPKG_CLASS2=ON - -DPKG_COLLOID=ON - -DPKG_COMPRESS=ON - -DPKG_CORESHELL=ON - -DPKG_DIPOLE=ON - -DPKG_GRANULAR=ON - -DPKG_KSPACE=ON - -DFFT=FFTW3 - -DPKG_MANYBODY=ON - -DPKG_MC=ON - -DPKG_MEAM=ON - -DPKG_MISC=ON - -DPKG_MOLECULE=ON - -DPKG_PERI=ON - -DPKG_QEQ=ON - -DPKG_REAX=ON - -DPKG_REPLICA=ON - -DPKG_RIGID=ON - -DPKG_SHOCK=ON - -DPKG_SNAP=ON - -DPKG_SRD=ON - -DPKG_PYTHON=ON - -DPKG_MPIIO=$(usex mpi) - -DPKG_VORONOI=ON - -DPKG_USER-ATC=ON - -DPKG_USER-AWPMD=ON - -DPKG_USER-CGDNA=ON - -DPKG_USER-CGSDK=ON - -DPKG_USER-COLVARS=ON - -DPKG_USER-DIFFRACTION=ON - -DPKG_USER-DPD=ON - -DPKG_USER-DRUDE=ON - -DPKG_USER-EFF=ON - -DPKG_USER-FEP=ON - -DPKG_USER-H5MD=$(usex mpi) - -DPKG_USER-LB=$(usex mpi) - -DPKG_USER-MANIFOLD=ON - -DPKG_USER-MEAMC=ON - -DPKG_USER-MGPT=ON - -DPKG_USER-MISC=ON - -DPKG_USER-MOLFILE=ON - -DPKG_USER-NETCDF=$(usex netcdf) - -DPKG_USER-PHONON=ON - -DPKG_USER-QTB=ON - -DPKG_USER-REAXC=ON - -DPKG_USER-SMD=ON - -DPKG_USER-SMTBQ=ON - -DPKG_USER-SPH=ON - -DPKG_USER-TALLY=ON - ) - cmake-utils_src_configure -} - -src_install() { - cmake-utils_src_install - - # Install python script. - use python && python_foreach_impl python_domodule "${S}"/../python/lammps.py - - if use examples; then - for d in examples bench; do - local LAMMPS_EXAMPLES="/usr/share/${PN}/${d}" - insinto "${LAMMPS_EXAMPLES}" - doins -r "${S}"/../${d}/* - done - fi -} |