101 lines
2.1 KiB
Bash
101 lines
2.1 KiB
Bash
# Copyright 1999-2015 Gentoo Foundation
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# Distributed under the terms of the GNU General Public License v2
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EAPI=5
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PYTHON_COMPAT=( python2_7 )
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inherit autotools eutils python-any-r1 versionator
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MY_PN="autodocksuite"
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MY_P="${MY_PN}-${PV}"
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DESCRIPTION="A suite of automated docking tools"
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HOMEPAGE="http://autodock.scripps.edu/"
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SRC_URI="http://autodock.scripps.edu/downloads/autodock-registration/tars/dist$(delete_all_version_separators)/${MY_P}-src.tar.gz"
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LICENSE="GPL-2"
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SLOT="0"
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KEYWORDS="~amd64 ~x86"
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IUSE="examples openmp test"
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RDEPEND=""
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DEPEND="test? ( ${PYTHON_DEPS} )"
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S="${WORKDIR}/src"
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PATCHES=(
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"${FILESDIR}"/${P}-buildsystem.patch
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)
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src_prepare() {
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local i
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epatch "${PATCHES[@]}"
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sed \
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-e "s/\tcsh/\tsh/" \
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-i auto{dock,grid}/Makefile.am || die
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for i in autodock autogrid; do
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pushd $i &>/dev/null
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eautoreconf
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popd &>/dev/null
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done
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}
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src_configure() {
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local i
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for i in autodock autogrid; do
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pushd $i &>/dev/null
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econf $(use_enable openmp)
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popd &>/dev/null
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done
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}
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src_compile() {
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emake -C autodock
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emake -C autogrid
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}
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src_test() {
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elog "Testing autodock"
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cd "${S}/autodock/Tests" || die
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cp ../*.dat . || die
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${EPYTHON} test_autodock4.py || die "AutoDock tests failed."
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einfo "Testing autogrid"
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cd "${S}/autogrid/Tests" || die
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${EPYTHON} test_autogrid4.py || die "AutoGrid tests failed."
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}
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src_install() {
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if use openmp; then
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newbin autodock/autodock4.omp ${PN}4
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dobin autogrid/autogrid4
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else
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dobin autodock/autodock4 autogrid/autogrid4
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fi
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insinto /usr/share/${PN}
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doins -r \
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autodock/{AD4_parameters.dat,AD4_PARM99.dat} \
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$(usex examples "autodoc/EXAMPLES" "")
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DOCS=(
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RELEASENOTES
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autodock/{AUTHORS,README}
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autodock/USERGUIDES/AutoDock4.{0,1,2}_UserGuide.doc
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autodock/USERGUIDES/AutoDock4.2_UserGuide.pdf
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)
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einstalldocs
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}
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pkg_postinst() {
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elog "The AutoDock development team requests all users to fill out the"
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elog "registration form at:"
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echo
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elog "\thttp://autodock.scripps.edu/downloads/autodock-registration"
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echo
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elog "The number of unique users of AutoDock is used by Prof. Arthur J."
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elog "Olson and the Scripps Research Institude to support grant"
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elog "applications."
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}
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