diff options
Diffstat (limited to 'sci-chemistry/refmac/refmac-5.5.0105.ebuild')
-rw-r--r-- | sci-chemistry/refmac/refmac-5.5.0105.ebuild | 66 |
1 files changed, 66 insertions, 0 deletions
diff --git a/sci-chemistry/refmac/refmac-5.5.0105.ebuild b/sci-chemistry/refmac/refmac-5.5.0105.ebuild new file mode 100644 index 000000000..68b90a568 --- /dev/null +++ b/sci-chemistry/refmac/refmac-5.5.0105.ebuild @@ -0,0 +1,66 @@ +# Copyright 1999-2009 Gentoo Foundation +# Distributed under the terms of the GNU General Public License v2 +# $Header: $ + +EAPI="2" + +inherit fortran base toolchain-funcs versionator + +DESCRIPTION="Macromolecular crystallographic refinement program" +HOMEPAGE="http://www.ysbl.york.ac.uk/~garib/refmac/" +SRC_URI="${HOMEPAGE}data/refmac_stable/refmac_${PV}.tar.gz + test? ( http://dev.gentooexperimental.org/~jlec/distfiles/test-framework.tar.gz )" + +SLOT="0" +LICENSE="ccp4" +KEYWORDS="~amd64 ~x86" +IUSE="test" +RESTRICT="mirror" + +RDEPEND="virtual/lapack + virtual/blas + sci-libs/ccp4-libs" +DEPEND="${RDEPEND}" + +S="${WORKDIR}" + +PATCHES=( + "${FILESDIR}"/$(get_version_component_range 1-2 ${PV})-allow-dynamic-linking.patch + ) + +src_prepare() { + base_src_prepare + use test && epatch "${FILESDIR}"/test.log.patch +} + +src_compile() { + emake \ + FC=$(tc-getFC) \ + CC=$(tc-getCC) \ + CXX=$(tc-getCXX) \ + COPTIM="${CFLAGS}" \ + FOPTIM="${FFLAGS:- -O2}" \ + VERSION="" \ + XFFLAGS="-fno-second-underscore" \ + LLIBCCP="-lccp4f -lccp4c -lccif -lmmdb -lstdc++" \ + LLIBLAPACK="-llapack -lblas" \ + || die +} + +src_test() { + einfo "Starting tests ..." + export PATH="${WORKDIR}/test-framework/scripts:${S}:${PATH}" + export CCP4_TEST="${WORKDIR}"/test-framework + export CCP4_SCR="${T}" + ln -sf refmac "${S}"/refmac5 + sed '/^ANISOU/d' -i ${CCP4_TEST}/data/pdb/1vr7.pdb + ccp4-run-thorough-tests -v test_refmac5 || die +} + +src_install() { + for i in refmac libcheck makecif; do + dobin ${i} || die + done + dosym refmac /usr/bin/refmac5 || die + dodoc refmac_keywords.pdf bugs_and_features.pdf || die +} |