diff options
author | V3n3RiX <venerix@koprulu.sector> | 2023-05-02 23:23:40 +0100 |
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committer | V3n3RiX <venerix@koprulu.sector> | 2023-05-02 23:23:40 +0100 |
commit | f20958f66a5e97c92cc44354e07e3e3089dfc23d (patch) | |
tree | fbf2993fb14c0f373d35922030b711e3fda4f864 /sci-chemistry/MDAnalysis | |
parent | e805507c58bab294dddb75f6fc9b551d9d92de86 (diff) |
gentoo auto-resync : 02:05:2023 - 23:23:39
Diffstat (limited to 'sci-chemistry/MDAnalysis')
-rw-r--r-- | sci-chemistry/MDAnalysis/MDAnalysis-2.4.3.ebuild | 39 | ||||
-rw-r--r-- | sci-chemistry/MDAnalysis/Manifest | 2 |
2 files changed, 41 insertions, 0 deletions
diff --git a/sci-chemistry/MDAnalysis/MDAnalysis-2.4.3.ebuild b/sci-chemistry/MDAnalysis/MDAnalysis-2.4.3.ebuild new file mode 100644 index 000000000000..5e7d91b36bf3 --- /dev/null +++ b/sci-chemistry/MDAnalysis/MDAnalysis-2.4.3.ebuild @@ -0,0 +1,39 @@ +# Copyright 1999-2023 Gentoo Authors +# Distributed under the terms of the GNU General Public License v2 + +EAPI=8 + +PYTHON_COMPAT=( python3_{9..10} ) + +DISTUTILS_USE_PEP517=setuptools +PYPI_NO_NORMALIZE=1 + +inherit distutils-r1 pypi + +DESCRIPTION="A python library to analyze and manipulate molecular dynamics trajectories" +HOMEPAGE="https://www.mdanalysis.org" + +SLOT="0" +LICENSE="GPL-2" +KEYWORDS="~amd64 ~x86 ~amd64-linux ~x86-linux" + +# TODO: fix this +# ImportError: MDAnalysis not installed properly. This can happen if your C extensions have not been built. +RESTRICT="test" + +RDEPEND=" + >=dev-python/numpy-1.16.0[${PYTHON_USEDEP}] + >=dev-python/scipy-1.0.0[${PYTHON_USEDEP}] + >=sci-biology/biopython-1.71[${PYTHON_USEDEP}] + >=dev-python/networkx-1.0[${PYTHON_USEDEP}] + >=dev-python/GridDataFormats-0.4.0[${PYTHON_USEDEP}] + >=dev-python/joblib-0.12[${PYTHON_USEDEP}] + >=dev-python/matplotlib-1.5.1[${PYTHON_USEDEP}] + >=dev-python/mmtf-python-1.0.0[${PYTHON_USEDEP}] + >=dev-python/tqdm-4.43.0[${PYTHON_USEDEP}] + >=dev-python/gsd-1.9.3[${PYTHON_USEDEP}] + dev-python/threadpoolctl[${PYTHON_USEDEP}] +" +BDEPEND="${RDEPEND}" + +distutils_enable_tests pytest diff --git a/sci-chemistry/MDAnalysis/Manifest b/sci-chemistry/MDAnalysis/Manifest index 4a7f9b1dbab3..f8c58176d234 100644 --- a/sci-chemistry/MDAnalysis/Manifest +++ b/sci-chemistry/MDAnalysis/Manifest @@ -1,3 +1,5 @@ DIST MDAnalysis-2.4.1.tar.gz 3746899 BLAKE2B af63f74a31dcde8a68cbffe5158f2f955d5eda1345bcff6a19e8df3284101b1e85006de3326d29d4fe1867dc6b0c5f55467b9e3242704f97440c6a43b52f47b8 SHA512 796dad98c26bd36f30db166bea5ff782aa5e3ac5cddb1675b628fb753a4f645fb27e06d3986047e2ba21a22cd91f96d0ba8e529256ed960a2b7cf95204076927 +DIST MDAnalysis-2.4.3.tar.gz 3747565 BLAKE2B 733be78aa3e57e8bbb9c291606a86d9100cb904cc587fa3e44c4205596b4da7eb5c2247388655dcd145b45ca6ecb47a3f95d7d659d029232d1febd2ebc99ab51 SHA512 0870bc392ef8b8fbae68cf60d1df2f5d413f4d1235ca795421061fd32a8fe97867d5bd610288237a59d1075f31cc43d281ab2f1e7e8bb0767dac7d278b8453d8 EBUILD MDAnalysis-2.4.1.ebuild 1144 BLAKE2B b2fc1e7f4c328ec7b30a75c6328ab9b6191c22e5f7f47209a935b148a982a605a843c469a27c27cfe909181b8167df6c3d3d28644f4627fd511fc4ed077ad4ac SHA512 307f37fd9acf7044599cfe86a51796d67afda7308eff5dbab6ea12511003ba8ad1c902cdd099f6a9fcf23d43c81ccdbb12b0de17b083abd5d5bf5606f09f53b2 +EBUILD MDAnalysis-2.4.3.ebuild 1144 BLAKE2B b2fc1e7f4c328ec7b30a75c6328ab9b6191c22e5f7f47209a935b148a982a605a843c469a27c27cfe909181b8167df6c3d3d28644f4627fd511fc4ed077ad4ac SHA512 307f37fd9acf7044599cfe86a51796d67afda7308eff5dbab6ea12511003ba8ad1c902cdd099f6a9fcf23d43c81ccdbb12b0de17b083abd5d5bf5606f09f53b2 MISC metadata.xml 497 BLAKE2B ddd8c6379dfe6b6fe33160d31bda254774e0c8eb5f862cc51560097efc5c273fa972388c6fe8fb1bbedc11ab125a5487bb1d19002489be967fa3e8e209d7cc81 SHA512 03c1eb9bef1bc10d600169b221c65c87794f8b9bf8d0efb1dc6ddaa61a09d665722ed7d32087e3137b36aa7256b76371b9ce2cc92b34b1ed7d1c78ede6550287 |