69 lines
1.6 KiB
Bash
69 lines
1.6 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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# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/relax/relax-3.3.5.ebuild,v 1.1 2015/01/29 07:53:47 jlec Exp $
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EAPI=5
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PYTHON_COMPAT=( python2_7 )
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WX_GTK_VER="2.9"
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inherit eutils multiprocessing python-single-r1 scons-utils toolchain-funcs wxwidgets virtualx
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DESCRIPTION="Molecular dynamics by NMR data analysis"
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HOMEPAGE="http://www.nmr-relax.com/"
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SRC_URI="http://download.gna.org/relax/${P}.src.tar.bz2"
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SLOT="0"
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LICENSE="GPL-2"
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KEYWORDS="~amd64 ~x86 ~amd64-linux ~x86-linux"
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IUSE=""
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REQUIRED_USE="${PYTHON_REQUIRED_USE}"
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RDEPEND="
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${PYTHON_DEPS}
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dev-python/Numdifftools[${PYTHON_USEDEP}]
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dev-python/matplotlib[${PYTHON_USEDEP}]
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dev-python/numpy[${PYTHON_USEDEP}]
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dev-python/wxpython:${WX_GTK_VER}[${PYTHON_USEDEP}]
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sci-chemistry/molmol
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sci-chemistry/pymol[${PYTHON_USEDEP}]
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sci-chemistry/vmd
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>=sci-libs/bmrblib-1.0.3[${PYTHON_USEDEP}]
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>=sci-libs/minfx-1.0.11[${PYTHON_USEDEP}]
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sci-libs/scipy[${PYTHON_USEDEP}]
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sci-visualization/grace
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sci-visualization/opendx
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x11-libs/wxGTK:${WX_GTK_VER}[X]"
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DEPEND="${RDEPEND}
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media-gfx/pngcrush"
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pkg_setup() {
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python-single-r1_pkg_setup
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}
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src_prepare() {
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rm -rf minfx bmrblib extern/numdifftools || die
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tc-export CC
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}
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src_compile() {
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escons
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}
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src_test() {
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VIRTUALX_COMMAND="${EPYTHON} ./${PN}.py -x --traceback"
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virtualmake
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}
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src_install() {
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dodoc README docs/{CHANGES,COMMITTERS,JOBS,relax.pdf}
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python_moduleinto ${PN}
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python_domodule *
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rm ${PN} README || die
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make_wrapper ${PN}-nmr "${EPYTHON} $(python_get_sitedir)/${PN}/${PN}.py $@"
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}
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