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# Copyright 1999-2022 Gentoo Authors
# Distributed under the terms of the GNU General Public License v2
EAPI=8
PYTHON_COMPAT=( python3_10 )
inherit cmake python-single-r1
DESCRIPTION="Cheminformatics and machine-learning software written in C++ and Python"
HOMEPAGE="http://www.rdkit.org/"
SRC_URI="https://github.com/rdkit/rdkit/archive/Release_${PV//./_}.tar.gz -> ${P}.tar.gz"
S="${WORKDIR}/rdkit-Release_${PV//./_}"
LICENSE="BSD"
SLOT="0"
KEYWORDS="~amd64"
IUSE="+python static-libs test"
REQUIRED_USE="python? ( ${PYTHON_REQUIRED_USE} )"
RESTRICT="!test? ( test )"
RDEPEND="dev-libs/boost
python? (
$(python_gen_cond_dep '
dev-libs/boost:=[numpy,python,${PYTHON_USEDEP}]
dev-python/numpy[${PYTHON_USEDEP}]
')
${PYTHON_DEPS}
)
dev-cpp/catch:0
dev-libs/rapidjson
>=dev-db/sqlite-3"
DEPEND="${RDEPEND}"
PATCHES=(
"${FILESDIR}/${PN}-2021.09.4-find-rapidjson.patch"
)
src_configure() {
local mycmakeargs=(
-DCATCH_DIR="${EPREFIX}/usr/include/catch2"
-DCMAKE_INSTALL_PREFIX:PATH="${EPREFIX}/usr"
-DRDK_INSTALL_INTREE=0
-DRDK_BUILD_CPP_TESTS="$(usex test)"
-DRDK_INSTALL_STATIC_LIBS="$(usex static-libs)"
-DRDK_BUILD_PYTHON_WRAPPERS="$(usex python)"
# Disable things that trigger fetching and are not packaged
-DRDK_INSTALL_COMIC_FONTS=OFF
-DRDK_BUILD_COORDGEN_SUPPORT=OFF
-DRDK_BUILD_MAEPARSER_SUPPORT=OFF
-DRDK_USE_URF=OFF
)
cmake_src_configure
}
src_test() {
RDBASE="${WORKDIR}/${PN}-Release_2021_09_4_build" cmake_src_test
}
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