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# Copyright 1999-2011 Gentoo Foundation
# Distributed under the terms of the GNU General Public License v2
# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/ccp4-apps/ccp4-apps-6.1.3-r9.ebuild,v 1.2 2011/03/14 17:06:53 jlec Exp $
EAPI="3"
PYTHON_DEPEND="2"
inherit autotools eutils flag-o-matic gnuconfig python toolchain-funcs
MY_P="${PN/-apps}-${PV}"
SRC="ftp://ftp.ccp4.ac.uk/ccp4"
#UPDATE="04_03_09"
#PATCHDATE="090511"
PATCH_TOT="0"
# Here's a little scriptlet to generate this list from the provided
# index.patches file
#
# i=1; while read -a line; do [[ ${line//#} != ${line} ]] && continue;
# echo "PATCH${i}=( ${line[1]}"; echo "${line[0]} )"; (( i++ )); done <
# index.patches
#PATCH1=( src/topp_
#topp.f-r1.16.2.5-r1.16.2.6.diff )
#PATCH2=( .
#configure-r1.372.2.18-r1.372.2.19.diff )
DESCRIPTION="Protein X-ray crystallography toolkit"
HOMEPAGE="http://www.ccp4.ac.uk/"
RESTRICT="mirror"
SRC_URI="
${SRC}/${PV}/${MY_P}-core-src.tar.gz
http://dev.gentooexperimental.org/~jlec/distfiles/${PV}-oasis4.0.patch.bz2"
# patch tarball from upstream
[[ -n ${UPDATE} ]] && SRC_URI="${SRC_URI} ${SRC}/${PV}/updates/${P}-src-patch-${UPDATE}.tar.gz"
# patches created by us
[[ -n ${PATCHDATE} ]] && SRC_URI="${SRC_URI} http://dev.gentooexperimental.org/~jlec/science-dist/${PV}-${PATCHDATE}-updates.patch.bz2"
for i in $(seq $PATCH_TOT); do
NAME="PATCH${i}[1]"
SRC_URI="${SRC_URI}
${SRC}/${PV}/patches/${!NAME}"
done
LICENSE="ccp4"
SLOT="0"
KEYWORDS="~amd64 ~ppc ~x86 ~amd64-linux ~x86-linux"
IUSE="examples X"
X11DEPS="
x11-libs/libX11
x11-libs/libXaw
x11-libs/libXt
x11-libs/libxdl_view"
TKDEPS="
>=dev-lang/tk-8.3
>=dev-tcltk/blt-2.4
dev-tcltk/iwidgets
dev-tcltk/itcl
dev-tcltk/itk
>=dev-tcltk/tdom-0.8
dev-tcltk/tkimg
dev-tcltk/tktreectrl"
SCILIBS="
~sci-libs/ccp4-libs-${PV}
>=sci-libs/ccp4-libs-${PV}-r7
sci-libs/clipper
sci-libs/fftw:2.1
sci-libs/mmdb
virtual/blas
virtual/lapack"
SCIAPPS="
sci-chemistry/pdb-extract
sci-chemistry/pymol
sci-chemistry/rasmol
>=sci-chemistry/oasis-4.0-r1"
RDEPEND="
${TKDEPS}
${SCILIBS}
app-shells/tcsh
dev-python/pyxml
dev-libs/libxml2:2
dev-libs/libjwc_c
dev-libs/libjwc_f
dev-libs/boehm-gc
!app-office/sc
!<sci-chemistry/ccp4-6.1.3
X? ( ${X11DEPS} )"
DEPEND="${RDEPEND}
X? (
x11-misc/imake
x11-proto/inputproto
x11-proto/xextproto
)"
PDEPEND="${SCIAPPS}"
S="${WORKDIR}/${MY_P}"
pkg_setup() {
python_set_active_version 2
}
src_prepare() {
einfo "Applying upstream patches ..."
for patch in $(seq $PATCH_TOT); do
base="PATCH${patch}"
dir=$(eval echo \${${base}[0]})
p=$(eval echo \${${base}[1]})
pushd "${dir}" >& /dev/null
ccp_patch "${DISTDIR}/${p}"
popd >& /dev/null
done
einfo "Done."
echo
[[ -n ${PATCHDATE} ]] && epatch "${WORKDIR}"/${PV}-${PATCHDATE}-updates.patch
einfo "Applying Gentoo patches ..."
# it tries to create libdir, bindir etc on live system in configure
ccp_patch "${FILESDIR}"/${PV}-dont-make-dirs-in-configure.patch
# We already have sci-chemistry/rasmol
# Also remember to create the bindir.
ccp_patch "${FILESDIR}"/${PV}-dont-build-double-and-make-bindir.patch
# libraries come from sci-libs/ccp4-libs
ccp_patch "${FILESDIR}"/${PV}-dont-build-libs.patch
# We have seperate ebuilds for those
for bin in molref xia scala imosflm balbes; do
ccp_patch "${FILESDIR}"/${PV}-dont-build-${bin}.patch
done
# don't configure what is not build
ccp_patch "${FILESDIR}"/${PV}-dont-configure.patch
# Set python paths correctly
ccp_patch "${FILESDIR}"/${PV}-pythonpath.patch
# Set python paths correctly
ccp_patch "${FILESDIR}"/${PV}-pisa.patch
# Set python paths correctly
ccp_patch "${FILESDIR}"/${PV}-clipper-template.patch
# Fix upstreams code
ccp_patch "${FILESDIR}"/${PV}-impl-dec.patch
# Not renaming, but unbundling libs
ccp_patch "${FILESDIR}"/${PV}-rename-rapper-ng.patch
# Use pkg-config to detect BLAS/LAPCK
ccp_patch "${FILESDIR}"/${PV}-lapack.patch
# Update things for oasis 4 usage
epatch "${WORKDIR}"/${PV}-oasis4.0.patch
sed 's: oasis : :g' -i src/Makefile.in || die
einfo "Done." # done applying Gentoo patches
echo
sed \
-e "s:/usr:${EPREFIX}/usr:g" \
-e 's:-Wl,-rpath,$CLIB::g' \
-e 's: -rpath $CLIB::g' \
-e 's: -I${srcdir}/include/cpp_c_headers::g' \
-e 's:sleep 1:sleep .2:g' \
-i configure || die
find "${S}" -name "Makefile.*" \
-exec sed -e 's|_FLAGS-|_FLAGS:-|g' -e "s:\(eval \$([[:alnum:]]*)\):\1 \$(GENTOOLDFLAGS):g" -i '{}' \;
# Don't build refmac, sfcheck, balbes, molrep binaries; available from the standalone version
sed -i -e "/^REFMACTARGETS/s:^.*:REFMACTARGETS="":g" configure
# Rapper bundles libxml2 and boehm-gc. Don't build, use or install those.
pushd src/rapper 2>/dev/null
eautoreconf
popd 2>/dev/null
gnuconfig_update
python_convert_shebangs $(python_get_version) src/ccp4_pipeline_simple.py ./share/smartie/*.py
}
src_configure() {
# Build system is broken if we set LDFLAGS
export GENTOOLDFLAGS="${LDFLAGS}"
unset LDFLAGS
# These are broken with ./src/procheck/ps.f
filter-flags "-floop-*"
# GENTOO_OSNAME can be one of:
# irix irix64 sunos sunos64 aix hpux osf1 linux freebsd
# linux_compaq_compilers linux_intel_compilers generic Darwin
# ia64_linux_intel Darwin_ibm_compilers linux_ibm_compilers
if [[ "$(tc-getFC)" = "ifort" ]]; then
if use ia64; then
GENTOO_OSNAME="ia64_linux_intel"
else
# Should be valid for x86, maybe amd64
GENTOO_OSNAME="linux_intel_compilers"
fi
else
# Should be valid for x86 and amd64, at least
GENTOO_OSNAME="linux"
fi
# Sets up env
ln -s \
ccp4.setup-bash \
"${S}"/include/ccp4.setup
# We agree to the license by emerging this, set in LICENSE
sed -i \
-e "s~^\(^agreed=\).*~\1yes~g" \
"${S}"/configure
# Fix up variables -- need to reset CCP4_MASTER at install-time
sed -i \
-e "s~^\(setenv CCP4_MASTER.*\)/.*~\1${WORKDIR}~g" \
-e "s~^\(export CCP4_MASTER.*\)/.*~\1${WORKDIR}~g" \
-e "s~^\(.*export CBIN=.*\)\$CCP4.*~\1\$CCP4/libexec/ccp4/bin/~g" \
-e "s~^\(.*setenv CBIN .*\)\$CCP4.*~\1\$CCP4/libexec/ccp4/bin/~g" \
-e "s~^\(setenv CCP4I_TCLTK.*\)/usr/local/bin~\1${EPREFIX}/usr/bin~g" \
"${S}"/include/ccp4.setup*
# Set up variables for build
source "${S}"/include/ccp4.setup-sh
export CC=$(tc-getCC)
export CXX=$(tc-getCXX)
export COPTIM=${CFLAGS}
export CXXOPTIM=${CXXFLAGS}
# Default to -O2 if FFLAGS is unset
export FC=$(tc-getFC)
export FOPTIM=${FFLAGS:- -O2}
export BINSORT_SCR="${T}"
export CCP4_MASTER="${WORKDIR}"
export CCP4I_TCLTK="${EPREFIX}/usr/bin"
export MAKE="make ${MAKEOPTS} ${EXTRA_EMAKE}"
# Can't use econf, configure rejects unknown options like --prefix
./configure \
$(use_enable X x) \
--with-shared-libs \
--with-fftw="${EPREFIX}/usr" \
--with-warnings \
--disable-pdb_extract \
--disable-cctbx \
--disable-phaser \
--disable-diffractionImg \
--disable-clipper \
--disable-mosflm \
--disable-mrbump \
--tmpdir="${TMPDIR}" \
${GENTOO_OSNAME} || die "econf failed"
# We do this manually, since disabling the clipper libraries also
# disables the clipper programs
pushd src/clipper_progs 2>/dev/null
econf \
--prefix="${S}" \
--bindir="${ED}"/usr/libexec/ccp4/bin \
--with-ccp4="${S}" \
--with-clipper="${EPREFIX}/usr" \
--with-fftw="${EPREFIX}/usr" \
--with-mmdb="${EPREFIX}/usr" \
CXX=$(tc-getCXX)
popd 2>/dev/null
}
src_compile() {
# fsplit is required for the programs
pushd lib/src 2>/dev/null
emake fsplit -j1 || die
popd 2>/dev/null
# We do this manually, since disabling the clipper libraries also
# disables the clipper programs
pushd src/clipper_progs 2>/dev/null
emake || die
popd 2>/dev/null
emake -j1 || die "emake failed"
}
src_install() {
# Set up variables for build
source "${S}"/include/ccp4.setup-sh
# if we don't make this, a ton of programs fail to install
mkdir "${S}"/bin || die
# We do this manually, since disabling the clipper libraries also
# disables the clipper programs
pushd "${S}"/src/clipper_progs 2>/dev/null
emake install || die
popd 2>/dev/null
einstall || die "install failed"
# Collision with sci-chemistry/mrbump
rm -f "${S}"/bin/{mrbump,pydbviewer} || die
# Bins
exeinto /usr/libexec/ccp4/bin/
doexe "${S}"/bin/* || die
# Libs
for file in "${S}"/lib/*; do
if [[ -d ${file} ]]; then
continue
elif [[ -x ${file} ]]; then
dolib.so ${file} || die
else
insinto /usr/$(get_libdir)
doins ${file} || die
fi
done
rm -f "${S}"/include/ccp4.setup*
# smartie -- log parsing
insinto /usr/share/ccp4
doins -r "${S}"/share/smartie || die
# Install docs and examples
doman "${S}"/man/cat1/*
mv "${S}"/manual/README "${S}"/manual/README-manual
dodoc manual/* README CHANGES doc/* examples/README || die
rm "${ED}"/usr/share/doc/${PF}/GNUmakefile.*
rm "${ED}"/usr/share/doc/${PF}/COPYING.*
dohtml -r "${S}"/html/*
if use examples; then
for i in data rnase toxd; do
docinto examples/${i}
dodoc "${S}"/examples/${i}/*
done
docinto examples/tutorial
dohtml -r "${S}"/examples/tutorial/html examples/tutorial/tut.css
for i in data results; do
docinto examples/tutorial/${i}
dodoc "${S}"/examples/tutorial/${i}/*
done
for i in non-runnable runnable; do
docinto examples/unix/${i}
dodoc "${S}"/examples/unix/${i}/*
done
fi
# Needed for ccp4i docs to work
dosym ../../share/doc/${PF}/examples /usr/$(get_libdir)/ccp4/examples || die
dosym ../../share/doc/${PF}/html /usr/$(get_libdir)/ccp4/html || die
# Fix overlaps with other packages
rm -f "${ED}"/usr/share/man/man1/rasmol.1* "${ED}"/usr/lib/font84.dat || die
mv "${ED}"/usr/share/man/man1/truncate{,-ccp4}.1 || die
mv "${ED}"/usr/share/man/man1/rapper{,-ccp4}.1 || die
mv "${ED}"/usr/share/man/man1/sc{,-ccp4}.1 || die
cat >> "${T}"/baubles <<- EOF
#!${EPREFIX}/bin/bash
exec $(PYTHON) \${CCP4}/share/ccp4/smartie/baubles.py
EOF
exeinto /usr/libexec/ccp4/bin/
doexe "${T}"/baubles || die
}
# Epatch wrapper for bulk patching
ccp_patch() {
EPATCH_SINGLE_MSG=" ${1##*/} ..." epatch ${1}
}
|