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author | V3n3RiX <venerix@koprulu.sector> | 2022-09-01 19:24:10 +0100 |
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committer | V3n3RiX <venerix@koprulu.sector> | 2022-09-01 19:24:10 +0100 |
commit | b052fbf151106a4f47cac7fdf0ffff983decb773 (patch) | |
tree | 5d21279a4eeaf4076caee87654b610a0fe8a4051 /sci-physics/espresso/espresso-4.2.0.ebuild | |
parent | c3b55a6be7da027d97d8aef00ef88c3011121a42 (diff) |
gentoo auto-resync : 01:09:2022 - 19:24:10
Diffstat (limited to 'sci-physics/espresso/espresso-4.2.0.ebuild')
-rw-r--r-- | sci-physics/espresso/espresso-4.2.0.ebuild | 124 |
1 files changed, 124 insertions, 0 deletions
diff --git a/sci-physics/espresso/espresso-4.2.0.ebuild b/sci-physics/espresso/espresso-4.2.0.ebuild new file mode 100644 index 000000000000..fb6b55b2bc12 --- /dev/null +++ b/sci-physics/espresso/espresso-4.2.0.ebuild @@ -0,0 +1,124 @@ +# Copyright 1999-2022 Gentoo Authors +# Distributed under the terms of the GNU General Public License v2 + +EAPI=7 + +PYTHON_COMPAT=( python3_{8..11} ) +CMAKE_MAKEFILE_GENERATOR="emake" + +inherit cmake cuda python-single-r1 savedconfig + +DESCRIPTION="Extensible Simulation Package for Research on Soft matter" +HOMEPAGE="http://espressomd.org" + +if [[ ${PV} = 9999 ]]; then + EGIT_REPO_URI="https://github.com/${PN}md/${PN}.git" + EGIT_BRANCH="python" + inherit git-r3 +else + SRC_URI="https://github.com/${PN}md/${PN}/releases/download/${PV}/${P}.tar.gz" + KEYWORDS="~amd64 ~x86 ~amd64-linux" +fi +S="${WORKDIR}/${PN}" + +LICENSE="GPL-3" +SLOT="0" +IUSE="cuda doc examples +fftw +hdf5 test" + +# unittest_decorators not packaged +RESTRICT="test" + +REQUIRED_USE=" + ${PYTHON_REQUIRED_USE}" + +RDEPEND=" + ${PYTHON_DEPS} + $(python_gen_cond_dep ' + >=dev-python/cython-0.26.1[${PYTHON_USEDEP}] + dev-python/numpy[${PYTHON_USEDEP}] + ') + cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1 ) + fftw? ( sci-libs/fftw:3.0 ) + dev-libs/boost:=[mpi] + hdf5? ( sci-libs/hdf5:=[mpi] ) +" + +DEPEND="${RDEPEND} + doc? ( + app-doc/doxygen[dot] + dev-texlive/texlive-latexextra + virtual/latex-base + ) +" + +DOCS=( AUTHORS NEWS Readme.md ChangeLog ) + +PATCHES=( + "${FILESDIR}/${P}-fix-disable-test.patch" +) + +src_prepare() { + use cuda && cuda_src_prepare + cmake_src_prepare +} + +src_configure() { + mycmakeargs=( + -DWITH_CUDA=$(usex cuda) + -DPYTHON_EXECUTABLE="${PYTHON}" + -DWITH_TESTS=$(usex test) + -DINSTALL_PYPRESSO=OFF + -DCMAKE_DISABLE_FIND_PACKAGE_FFTW3=$(usex !fftw) + -DWITH_HDF5=$(usex hdf5) + -DCMAKE_DISABLE_FIND_PACKAGE_HDF5=$(usex !hdf5) + -DCMAKE_SKIP_RPATH=YES + ) + cmake_src_configure +} + +src_compile() { + cmake_src_compile + use doc && cmake_build doxygen + [[ ${PV} = 9999 ]] && use doc && cmake_build ug dg tutorials +} + +src_test() { + LD_PRELOAD="${BUILD_DIR}/src/core/Espresso_core.so" cmake_src_test +} + +src_install() { + local i docdir="${S}" + + cmake_src_install + + python_optimize + + insinto /usr/share/${PN}/ + doins "${BUILD_DIR}/myconfig-sample.hpp" + + save_config "${BUILD_DIR}/src/config/myconfig-final.hpp" + + if use doc; then + dodoc -r "${BUILD_DIR}/doc/doxygen/html" + fi + + if use examples; then + insinto "/usr/share/${PN}/examples/python" + doins -r samples/${i}/. + fi +} + +pkg_postinst() { + echo + elog "Please read and cite:" + elog "ESPResSo, Comput. Phys. Commun. 174(9) ,704, 2006." + elog "https://dx.doi.org/10.1016/j.cpc.2005.10.005" + echo + elog "If you need more features, change" + elog "/etc/portage/savedconfig/${CATEGORY}/${PF}" + elog "and reemerge with USE=savedconfig" + echo + elog "For a full feature list see:" + elog "/usr/share/${PN}/myconfig-sample.hpp" + echo +} |