40 lines
848 B
Bash
40 lines
848 B
Bash
# Copyright 1999-2020 Gentoo Authors
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# Distributed under the terms of the GNU General Public License v2
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EAPI=7
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PYTHON_COMPAT=( python3_{7,8} )
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inherit distutils-r1
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DESCRIPTION="pKa-value prediction of ionizable groups in protein and protein-ligand complexes"
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HOMEPAGE="https://github.com/jensengroup/propka"
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SRC_URI="mirror://pypi/${PN:0:1}/${PN}/${P}.tar.gz"
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SLOT="0"
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LICENSE="LGPL-2.1"
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KEYWORDS="~amd64 ~x86 ~amd64-linux ~x86-linux"
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IUSE="test"
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RESTRICT="!test? ( test )"
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RDEPEND="dev-python/numpy[${PYTHON_USEDEP}]"
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BDEPEND="test? (
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${RDEPEND}
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dev-python/pandas[${PYTHON_USEDEP}]
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)"
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python_prepare_all() {
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sed -e "/exclude/s:scripts:\', \'Tests:g" \
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-i setup.py || die
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distutils-r1_python_prepare_all
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}
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python_test() {
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cd Tests || die
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${PYTHON} runtest.py || die
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}
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python_install_all() {
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distutils-r1_python_install_all
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}
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