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Diffstat (limited to 'sci-chemistry/MDAnalysis/MDAnalysis-2.4.1.ebuild')
| -rw-r--r-- | sci-chemistry/MDAnalysis/MDAnalysis-2.4.1.ebuild | 39 |
1 files changed, 39 insertions, 0 deletions
diff --git a/sci-chemistry/MDAnalysis/MDAnalysis-2.4.1.ebuild b/sci-chemistry/MDAnalysis/MDAnalysis-2.4.1.ebuild new file mode 100644 index 000000000000..5d561772ca51 --- /dev/null +++ b/sci-chemistry/MDAnalysis/MDAnalysis-2.4.1.ebuild @@ -0,0 +1,39 @@ +# Copyright 1999-2022 Gentoo Authors +# Distributed under the terms of the GNU General Public License v2 + +EAPI=8 + +PYTHON_COMPAT=( python3_{8..10} ) + +DISTUTILS_USE_PEP517=setuptools + +inherit distutils-r1 + +DESCRIPTION="A python library to analyze and manipulate molecular dynamics trajectories" +HOMEPAGE="https://www.mdanalysis.org" +SRC_URI="mirror://pypi/M/${PN}/${P}.tar.gz" + +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 |