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author | Michał Górny <mgorny@gentoo.org> | 2020-02-08 13:36:34 +0100 |
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committer | Michał Górny <mgorny@gentoo.org> | 2020-02-09 16:54:21 +0100 |
commit | 0c2a5cb0f6a062b7da6f9a90cbb06e3784df29a6 (patch) | |
tree | 2d09a19a6500a48991d2dfabed98d2cf2aa4acc5 /sci-chemistry/pdb2pqr | |
parent | net-firewall/fwknop: Switch to python-single-r1 (diff) | |
download | gentoo-0c2a5cb0f6a062b7da6f9a90cbb06e3784df29a6.tar.gz gentoo-0c2a5cb0f6a062b7da6f9a90cbb06e3784df29a6.tar.bz2 gentoo-0c2a5cb0f6a062b7da6f9a90cbb06e3784df29a6.zip |
sci-chemistry/pdb2pqr: Switch to python-single-r1
Use python-single-r1 as requiered for the dep on sci-chemistry/apbs.
Signed-off-by: Michał Górny <mgorny@gentoo.org>
Diffstat (limited to 'sci-chemistry/pdb2pqr')
-rw-r--r-- | sci-chemistry/pdb2pqr/pdb2pqr-1.9.0-r3.ebuild (renamed from sci-chemistry/pdb2pqr/pdb2pqr-1.9.0-r2.ebuild) | 72 |
1 files changed, 27 insertions, 45 deletions
diff --git a/sci-chemistry/pdb2pqr/pdb2pqr-1.9.0-r2.ebuild b/sci-chemistry/pdb2pqr/pdb2pqr-1.9.0-r3.ebuild index ad95f8f410fa..179e6448d605 100644 --- a/sci-chemistry/pdb2pqr/pdb2pqr-1.9.0-r2.ebuild +++ b/sci-chemistry/pdb2pqr/pdb2pqr-1.9.0-r3.ebuild @@ -5,7 +5,7 @@ EAPI=5 PYTHON_COMPAT=( python2_7 ) -inherit scons-utils fortran-2 flag-o-matic python-r1 toolchain-funcs +inherit scons-utils fortran-2 flag-o-matic python-single-r1 toolchain-funcs DESCRIPTION="Automated pipeline for performing Poisson-Boltzmann electrostatics calculations" HOMEPAGE="https://www.poissonboltzmann.org/" @@ -19,13 +19,15 @@ KEYWORDS="amd64 x86 ~amd64-linux ~x86-linux" REQUIRED_USE="${PYTHON_REQUIRED_USE}" RDEPEND="${PYTHON_DEPS} - || ( - dev-python/numpy-python2[${PYTHON_USEDEP}] - dev-python/numpy[${PYTHON_USEDEP}] - ) - sci-chemistry/openbabel-python[${PYTHON_USEDEP}] - opal? ( dev-python/zsi[${PYTHON_USEDEP}] ) - pdb2pka? ( sci-chemistry/apbs[${PYTHON_USEDEP},-mpi] )" + $(python_gen_cond_dep ' + || ( + dev-python/numpy-python2[${PYTHON_MULTI_USEDEP}] + dev-python/numpy[${PYTHON_MULTI_USEDEP}] + ) + sci-chemistry/openbabel-python[${PYTHON_MULTI_USEDEP}] + opal? ( dev-python/zsi[${PYTHON_MULTI_USEDEP}] ) + ') + pdb2pka? ( sci-chemistry/apbs[${PYTHON_SINGLE_USEDEP},-mpi] )" DEPEND="${RDEPEND} dev-lang/swig:0" @@ -43,6 +45,7 @@ pkg_setup() { einfo "Allow usage of ${MAXATOMS} during calculations" fi fortran-2_pkg_setup + python-single-r1_pkg_setup } src_prepare() { @@ -54,15 +57,10 @@ src_prepare() { epatch "${PATCHES[@]}" tc-export CXX rm -rf scons || die - - python_copy_sources } src_configure() { - python_configure() { - cd "${BUILD_DIR}" || die - - cat > build_config.py <<- EOF + cat > build_config.py <<- EOF PREFIX="${D}/$(python_get_sitedir)/${PN}" #URL="http://<COMPUTER NAME>/pdb2pqr/" APBS="${EPREFIX}/usr/bin/apbs" @@ -71,51 +69,35 @@ src_configure() { MAX_ATOMS=${MAXATOMS} BUILD_PDB2PKA=$(usex pdb2pka True False) REBUILD_SWIG=True - EOF - } - - python_foreach_impl python_configure + EOF } src_compile() { - python_compile() { - cd "${BUILD_DIR}" || die - escons - } - python_foreach_impl python_compile + escons } src_test() { - python_test() { - local myesconsargs=( -j1 ) - cd "${BUILD_DIR}" || die - escons test - escons advtest - escons complete-test - } - python_foreach_impl python_test + local myesconsargs=( -j1 ) + escons test + escons advtest + escons complete-test } src_install() { dodir /usr/share/doc/${PF}/html - python_install() { - local lib - - cd "${BUILD_DIR}" || die + local lib - escons install + escons install - find "${D}$(python_get_sitedir)"/${PN}/{jmol,examples,doc,contrib} -delete || die + find "${D}$(python_get_sitedir)"/${PN}/{jmol,examples,doc,contrib} -delete || die - python_doscript "${FILESDIR}"/{${PN},pdb2pka} + python_doscript "${FILESDIR}"/{${PN},pdb2pka} - for lib in apbslib.py{,c,o}; do - dosym ../../apbs/${lib} $(python_get_sitedir)/${PN}/pdb2pka/${lib} - done - dosym ../../_apbslib.so $(python_get_sitedir)/${PN}/pdb2pka/_apbslib.so - python_optimize - } - python_foreach_impl python_install + for lib in apbslib.py{,c,o}; do + dosym ../../apbs/${lib} $(python_get_sitedir)/${PN}/pdb2pka/${lib} + done + dosym ../../_apbslib.so $(python_get_sitedir)/${PN}/pdb2pka/_apbslib.so + python_optimize if use doc; then pushd doc > /dev/null |