diff options
author | Markus Dittrich <markusle@gentoo.org> | 2009-11-03 05:30:06 +0000 |
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committer | Markus Dittrich <markusle@gentoo.org> | 2009-11-03 05:30:06 +0000 |
commit | 8bf0be67b3d80bf50994d72a893ef065bda1aa1d (patch) | |
tree | 1b14f6325f2175f97f7534d9ae268423d720dce1 /sci-chemistry | |
parent | version bump (diff) | |
download | gentoo-2-8bf0be67b3d80bf50994d72a893ef065bda1aa1d.tar.gz gentoo-2-8bf0be67b3d80bf50994d72a893ef065bda1aa1d.tar.bz2 gentoo-2-8bf0be67b3d80bf50994d72a893ef065bda1aa1d.zip |
Version bump (fixes bug #262905) and removed old ebuilds.
(Portage version: 2.1.7.3/cvs/Linux x86_64)
Diffstat (limited to 'sci-chemistry')
-rw-r--r-- | sci-chemistry/apbs/ChangeLog | 13 | ||||
-rw-r--r-- | sci-chemistry/apbs/apbs-0.5.0.ebuild | 68 | ||||
-rw-r--r-- | sci-chemistry/apbs/apbs-0.5.1.ebuild | 70 | ||||
-rw-r--r-- | sci-chemistry/apbs/apbs-1.2.0.ebuild | 96 | ||||
-rw-r--r-- | sci-chemistry/apbs/files/apbs-1.2.0-contrib.patch | 10 | ||||
-rw-r--r-- | sci-chemistry/apbs/files/apbs-1.2.0-install-fix.patch | 39 | ||||
-rw-r--r-- | sci-chemistry/apbs/files/apbs-1.2.0-link.patch | 23 | ||||
-rw-r--r-- | sci-chemistry/apbs/files/apbs-examples-gentoo.patch | 30 | ||||
-rw-r--r-- | sci-chemistry/apbs/files/apbs-gcc4-gentoo.patch | 20 | ||||
-rw-r--r-- | sci-chemistry/apbs/metadata.xml | 3 |
10 files changed, 183 insertions, 189 deletions
diff --git a/sci-chemistry/apbs/ChangeLog b/sci-chemistry/apbs/ChangeLog index 48d3f53bd63e..5f38dafade0a 100644 --- a/sci-chemistry/apbs/ChangeLog +++ b/sci-chemistry/apbs/ChangeLog @@ -1,6 +1,17 @@ # ChangeLog for sci-chemistry/apbs # Copyright 1999-2009 Gentoo Foundation; Distributed under the GPL v2 -# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/apbs/ChangeLog,v 1.21 2009/05/06 21:05:52 maekke Exp $ +# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/apbs/ChangeLog,v 1.22 2009/11/03 05:30:06 markusle Exp $ + +*apbs-1.2.0 (03 Nov 2009) + + 03 Nov 2009; Markus Dittrich <markusle@gentoo.org> -apbs-0.5.0.ebuild, + -apbs-0.5.1.ebuild, +apbs-1.2.0.ebuild, +files/apbs-1.2.0-contrib.patch, + +files/apbs-1.2.0-install-fix.patch, +files/apbs-1.2.0-link.patch, + -files/apbs-examples-gentoo.patch, -files/apbs-gcc4-gentoo.patch, + metadata.xml: + Version bump (fixes bug #262905) and removed old ebuilds. Currently + missing is opal support (needs keywording by ppc) as well as fetk + support. Thanks much to Justin Lecher for his ebuild. 06 May 2009; Markus Meier <maekke@gentoo.org> apbs-1.0.0-r1.ebuild: amd64/x86 stable, bug #250903 diff --git a/sci-chemistry/apbs/apbs-0.5.0.ebuild b/sci-chemistry/apbs/apbs-0.5.0.ebuild deleted file mode 100644 index 19043a78c5bf..000000000000 --- a/sci-chemistry/apbs/apbs-0.5.0.ebuild +++ /dev/null @@ -1,68 +0,0 @@ -# Copyright 1999-2009 Gentoo Foundation -# Distributed under the terms of the GNU General Public License v2 -# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/apbs/apbs-0.5.0.ebuild,v 1.4 2009/02/05 05:44:50 darkside Exp $ - -inherit eutils fortran - -MY_P="${P}-source-2" -S="${WORKDIR}"/"${MY_P}" - -DESCRIPTION=" Software for evaluating the electrostatic properties of nanoscale biomolecular systems" -LICENSE="GPL-2" -HOMEPAGE="http://apbs.sourceforge.net/" -SRC_URI="mirror://sourceforge/${PN}/${MY_P}.tar.gz" - -SLOT="0" -IUSE="blas mpi" -KEYWORDS="~ppc ~x86 ~amd64" - -DEPEND="blas? ( virtual/blas ) - sys-libs/readline - mpi? ( virtual/mpi )" - -FORTRAN="g77 gfortran" - -pkg_setup() { - # It is important that you use the same compiler to compile - # APBS that you used when compiling MPI. - fortran_pkg_setup -} - -src_compile() { - - # use blas - use blas && local myconf="--with-blas=-lblas" - - use mpi && myconf="${myconf} --with-mpiinc=/usr/include" - - econf ${myconf} || die "configure failed" - - # build - make DESTDIR="${D}" || die "make failed" -} - -src_install() { - - # install apbs binary - dobin bin/apbs || die "failed to install apbs binary" - - # remove useless files and install docs - find ./examples -name 'test.sh' -exec rm -f {} \; || \ - die "Failed to remove test.sh files" - find ./examples -name 'Makefile*' -exec rm -f {} \; || \ - die "Failed to remove Makefiles" - find ./tools -name 'Makefile*' -exec rm -f {} \; || \ - die "Failed to remove Makefiles" - - dohtml -r doc/index.html doc/programmer doc/tutorial \ - doc/user-guide doc/license || \ - die "Failed to install html docs" - - insinto /usr/share/doc/${PF}/examples - doins -r examples/* || \ - die "Failed to install examples" - - insinto /usr/share/${PF}/tools - doins -r tools/* || die "failed to install tools" - -} diff --git a/sci-chemistry/apbs/apbs-0.5.1.ebuild b/sci-chemistry/apbs/apbs-0.5.1.ebuild deleted file mode 100644 index 868d07fce050..000000000000 --- a/sci-chemistry/apbs/apbs-0.5.1.ebuild +++ /dev/null @@ -1,70 +0,0 @@ -# Copyright 1999-2009 Gentoo Foundation -# Distributed under the terms of the GNU General Public License v2 -# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/apbs/apbs-0.5.1.ebuild,v 1.4 2009/02/05 05:44:50 darkside Exp $ - -inherit eutils fortran - -MY_P="${P}-source" -S="${WORKDIR}"/"${MY_P}" - -DESCRIPTION=" Software for evaluating the electrostatic properties of nanoscale biomolecular systems" -LICENSE="GPL-2" -HOMEPAGE="http://apbs.sourceforge.net/" -SRC_URI="mirror://sourceforge/${PN}/${MY_P}.tgz" - -SLOT="0" -IUSE="blas mpi" -KEYWORDS="~ppc ~x86 ~amd64" - -DEPEND="blas? ( virtual/blas ) - sys-libs/readline - mpi? ( virtual/mpi )" - -FORTRAN="g77 gfortran" - -pkg_setup() { - # It is important that you use the same compiler to compile - # APBS that you used when compiling MPI. - fortran_pkg_setup -} - -src_compile() { - # fix apbsblas - sed -e "s:-L\${prefix}/lib -lapbsblas:${S}//contrib/blas/.libs/libapbsblas.a:" \ - -i configure \ - || die "failed to fix configure" - - # use blas - use blas && local myconf="--with-blas=-lblas" - - use mpi && myconf="${myconf} --with-mpiinc=/usr/include" - - econf ${myconf} || die "configure failed" - - # build - make DESTDIR="${D}" || die "make failed" -} - -src_install() { - # install apbs binary - dobin bin/apbs || die "failed to install apbs binary" - - # remove useless files and install docs - find ./examples -name 'test.sh' -exec rm -f {} \; || \ - die "Failed to remove test.sh files" - find ./examples -name 'Makefile*' -exec rm -f {} \; || \ - die "Failed to remove Makefiles" - find ./tools -name 'Makefile*' -exec rm -f {} \; || \ - die "Failed to remove Makefiles" - - dohtml -r doc/index.html doc/programmer doc/tutorial \ - doc/user-guide doc/license || \ - die "Failed to install html docs" - - insinto /usr/share/doc/${PF}/examples - doins -r examples/* || \ - die "Failed to install examples" - - insinto /usr/share/${PN}/tools - doins -r tools/* || die "failed to install tools" -} diff --git a/sci-chemistry/apbs/apbs-1.2.0.ebuild b/sci-chemistry/apbs/apbs-1.2.0.ebuild new file mode 100644 index 000000000000..55c69b2aac41 --- /dev/null +++ b/sci-chemistry/apbs/apbs-1.2.0.ebuild @@ -0,0 +1,96 @@ +# Copyright 1999-2009 Gentoo Foundation +# Distributed under the terms of the GNU General Public License v2 +# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/apbs/apbs-1.2.0.ebuild,v 1.1 2009/11/03 05:30:06 markusle Exp $ + +EAPI="2" + +inherit eutils fortran autotools python versionator flag-o-matic + +MY_PV=$(get_version_component_range 1-2) +MY_P="${PN}-${MY_PV}-source" +S="${WORKDIR}"/"${MY_P}" + +DESCRIPTION=" Software for evaluating the electrostatic properties of nanoscale biomolecular systems" +LICENSE="BSD" +HOMEPAGE="http://apbs.sourceforge.net/" +SRC_URI="mirror://sourceforge/${PN}/${MY_P}.tar.gz" + +SLOT="0" +IUSE="arpack blas doc mpi python openmp" +KEYWORDS="~x86 ~amd64 ~ppc" + +DEPEND="dev-libs/maloc[mpi=] + blas? ( virtual/blas ) + python? ( dev-lang/python ) + sys-libs/readline + arpack? ( sci-libs/arpack ) + mpi? ( virtual/mpi )" +RDEPEND="${DEPEND}" + +FORTRAN="g77 gfortran ifc" + +src_prepare() { + python_version + + epatch "${FILESDIR}"/${P}-install-fix.patch + epatch "${FILESDIR}"/${P}-contrib.patch + epatch "${FILESDIR}"/${P}-link.patch + sed "s:GENTOO_PKG_NAME:${PN}:g" \ + -i Makefile.am || die "Cannot correct package name" + eautoreconf +} + +src_configure() { + local myconf="--docdir=/usr/share/doc/${PF}" + use blas && myconf="${myconf} --with-blas=-lblas" + use arpack && myconf="${myconf} --with-arpack=/usr/$(get_libdir)" + + # check which mpi version is installed and tell configure + if use mpi; then + export CC="/usr/bin/mpicc" + export F77="/usr/bin/mpif77" + + if has_version sys-cluster/mpich; then + myconf="${myconf} --with-mpich=/usr" + elif has_version sys-cluster/mpich2; then + myconf="${myconf} --with-mpich2=/usr" + elif has_version sys-cluster/lam-mpi; then + myconf="${myconf} --with-lam=/usr" + elif has_version sys-cluster/openmpi; then + myconf="${myconf} --with-openmpi=/usr" + fi + fi || die "Failed to select proper mpi implementation" + + # apbs' configure's openmp detection is broken; we'll + # work around this until it is fixed + if use openmp; then + append-flags -fopenmp + else + myconf="${myconf} --disable-openmp" + fi + + econf $(use_enable python) \ + --disable-maloc-rebuild \ + ${myconf} || die "configure failed" +} + +src_compile() { + emake -j1 || die "make failed" +} + +src_test() { + cd examples && make test \ + || die "Tests failed" +} + +src_install() { + emake -j1 DESTDIR="${D}" install \ + || die "make install failed" + + dodoc AUTHORS INSTALL README NEWS ChangeLog \ + || die "Failed to install docs" + + if use doc; then + dohtml -r doc/* || die "Failed to install html docs" + fi +} diff --git a/sci-chemistry/apbs/files/apbs-1.2.0-contrib.patch b/sci-chemistry/apbs/files/apbs-1.2.0-contrib.patch new file mode 100644 index 000000000000..6bfc9ffaa790 --- /dev/null +++ b/sci-chemistry/apbs/files/apbs-1.2.0-contrib.patch @@ -0,0 +1,10 @@ +--- contrib/Makefile.am 2009-03-05 21:30:09.000000000 +0100 ++++ contrib/Makefile.am.new 2009-04-24 19:08:39.000000000 +0200 +@@ -9,6 +9,6 @@ + AUTOMAKE_OPTIONS = no-dependencies + SUFFIXES = .H .h .C .c .f .o + +-always_built_SUBDIRS = @apbs_do_blas@ @apbs_do_maloc@ pmgZ aqua opal ++always_built_SUBDIRS = @apbs_do_blas@ @apbs_do_maloc@ pmgZ aqua + + SUBDIRS = $(always_built_SUBDIRS) . diff --git a/sci-chemistry/apbs/files/apbs-1.2.0-install-fix.patch b/sci-chemistry/apbs/files/apbs-1.2.0-install-fix.patch new file mode 100644 index 000000000000..1d6f130a522a --- /dev/null +++ b/sci-chemistry/apbs/files/apbs-1.2.0-install-fix.patch @@ -0,0 +1,39 @@ +diff -Naur apbs-1.2-source/Makefile.am apbs-1.2-source.new/Makefile.am +--- apbs-1.2-source/Makefile.am 2009-10-14 13:20:55.000000000 -0400 ++++ apbs-1.2-source.new/Makefile.am 2009-11-02 23:31:41.000000000 -0500 +@@ -28,10 +28,19 @@ + -rm -f ./bin/apbs + + install-data-local: +- mkdir -p ${prefix}/share +- -cp -rf examples ${prefix}/share +- -cp -rf doc ${prefix}/share +- -cp -rf tools ${prefix}/share ++ mkdir -p $(DESTDIR)${prefix}/share/GENTOO_PKG_NAME/examples ++ mkdir -p $(DESTDIR)${prefix}/share/GENTOO_PKG_NAME/tools ++ -rm -f doc/LICENSE.txt ++ -rm -f tools/manip/*.pyc ++ -rm -f tools/**/*.o ++ -rm -f tools/**/Makefile* ++ -rm -f tools/**/**/*.o ++ -rm -f tools/**/**/Makefile* ++ -rm -f tools/Makefile* ++ -rm -f examples/Makefile* ++ -rm -f examples/**/Makefile* ++ -cp -rf examples $(DESTDIR)${prefix}/share/GENTOO_PKG_NAME/ ++ -cp -rf tools $(DESTDIR)${prefix}/share/GENTOO_PKG_NAME/ + + test: + cd examples; make test +diff -Naur apbs-1.2-source/bin/Makefile.am apbs-1.2-source.new/bin/Makefile.am +--- apbs-1.2-source/bin/Makefile.am 2009-10-14 13:20:48.000000000 -0400 ++++ apbs-1.2-source.new/bin/Makefile.am 2009-11-02 23:31:15.000000000 -0500 +@@ -40,6 +40,4 @@ + include_HEADERS = routines.h + + install-data-local: +- -cp -p ${top_apbsdir}/bin/ApbsClient.py ${prefix}/bin +- -chmod 755 ${prefix}/bin/ApbsClient.py +- -rm -f ${prefix}/bin/wsdl2py +\ No newline at end of file ++ -rm -f $(DESTDIR)${prefix}/bin/wsdl2py diff --git a/sci-chemistry/apbs/files/apbs-1.2.0-link.patch b/sci-chemistry/apbs/files/apbs-1.2.0-link.patch new file mode 100644 index 000000000000..ae64793423b7 --- /dev/null +++ b/sci-chemistry/apbs/files/apbs-1.2.0-link.patch @@ -0,0 +1,23 @@ +diff -Naur apbs-1.2-source/tools/python/Makefile.am apbs-1.2-source.new/tools/python/Makefile.am +--- apbs-1.2-source/tools/python/Makefile.am 2009-10-14 13:20:57.000000000 -0400 ++++ apbs-1.2-source.new/tools/python/Makefile.am 2009-10-29 16:08:18.000000000 -0400 +@@ -15,5 +15,5 @@ + + noinst_PROGRAMS = _apbslib.so + _apbslib_so_SOURCES = apbslib.c +-_apbslib_so_LINK = $(PY_CC) $(PY_LINKFLAGS) -o $@ $(PY_SHARED) +-_apbslib_so_LDADD = ${top_builddir}/bin/.libs/libapbsmainroutines.a ${top_builddir}/src/aaa_lib/.libs/libapbs.a ${top_builddir}/contrib/lib/libmaloc.a ${top_builddir}/contrib/blas/.libs/libapbsblas.a $(PY_LDFLAGS) ++_apbslib_so_LINK = $(PY_CC) $(PY_LINKFLAGS) $(LDFLAGS) -o $@ $(PY_SHARED) ++_apbslib_so_LDADD = ${top_builddir}/bin/.libs/libapbsmainroutines.a ${top_builddir}/src/aaa_lib/.libs/libapbs.a $(PY_LDFLAGS) +diff -Naur apbs-1.2-source/tools/python/vgrid/Makefile.am apbs-1.2-source.new/tools/python/vgrid/Makefile.am +--- apbs-1.2-source/tools/python/vgrid/Makefile.am 2009-10-14 13:20:57.000000000 -0400 ++++ apbs-1.2-source.new/tools/python/vgrid/Makefile.am 2009-10-29 16:08:29.000000000 -0400 +@@ -15,6 +15,6 @@ + if PY_PRESENT + noinst_PROGRAMS = _vgrid.so + _vgrid_so_SOURCES = vgridlib.c +- _vgrid_so_LINK = $(PY_CC) $(PY_LINKFLAGS) -o $@ $(PY_SHARED) +- _vgrid_so_LDADD = ${top_builddir}/bin/.libs/libapbsmainroutines.a ${top_builddir}/src/aaa_lib/.libs/libapbs.a $(PY_LDFLAGS) ${top_builddir}/contrib/lib/libmaloc.a @lib_list@ ++ _vgrid_so_LINK = $(PY_CC) $(PY_LINKFLAGS) $(LDFLAGS) -o $@ $(PY_SHARED) ++ _vgrid_so_LDADD = ${top_builddir}/bin/.libs/libapbsmainroutines.a ${top_builddir}/src/aaa_lib/.libs/libapbs.a @lib_list@ + endif diff --git a/sci-chemistry/apbs/files/apbs-examples-gentoo.patch b/sci-chemistry/apbs/files/apbs-examples-gentoo.patch deleted file mode 100644 index 5c82bc2882ab..000000000000 --- a/sci-chemistry/apbs/files/apbs-examples-gentoo.patch +++ /dev/null @@ -1,30 +0,0 @@ -diff -Naur apbs-0.4.0/examples/born/runme apbs-0.4.0-new/examples/born/runme ---- apbs-0.4.0/examples/born/runme 2002-08-13 14:35:41.000000000 +0000 -+++ apbs-0.4.0-new/examples/born/runme 2006-03-09 03:15:09.000000000 +0000 -@@ -8,5 +8,5 @@ - echo "Generating ion with $i radius..." - echo "ATOM 1 I ION 1 0.000 0.000 0.000 1.00 $i" \ - > ion.pqr -- ${bindir}/apbs apbs.in > OUTPUT-${i} 2>&1 -+ /usr/bin/apbs apbs.in > OUTPUT-${i} 2>&1 - done -diff -Naur apbs-0.4.0/examples/ion-pmf/runme apbs-0.4.0-new/examples/ion-pmf/runme ---- apbs-0.4.0/examples/ion-pmf/runme 2002-08-13 14:35:41.000000000 +0000 -+++ apbs-0.4.0-new/examples/ion-pmf/runme 2006-03-09 03:16:11.000000000 +0000 -@@ -14,5 +14,5 @@ - echo "ATOM 1 I ION 1 $i 0.000 0.000 1.00 2.00"\ - > mol2.pqr - cat mol1.pqr mol2.pqr > complex.pqr -- ${bindir}/apbs apbs.in > OUTPUT_${i} 2>&1 -+ /usr/bin/apbs apbs.in > OUTPUT_${i} 2>&1 - done -diff -Naur apbs-0.4.0/examples/point-pmf/runme.sh apbs-0.4.0-new/examples/point-pmf/runme.sh ---- apbs-0.4.0/examples/point-pmf/runme.sh 2004-02-12 17:14:02.000000000 +0000 -+++ apbs-0.4.0-new/examples/point-pmf/runme.sh 2006-03-09 03:17:11.000000000 +0000 -@@ -20,5 +20,5 @@ - echo "ATOM 1 I ION 1 $i 0.000 0.000 1.00 0.00"\ - > mol2.pqr - cat mol1.pqr mol2.pqr > complex.pqr -- ${bindir}/apbs apbs.in > OUTPUT_${i} 2>&1 -+ /usr/bin/apbs apbs.in > OUTPUT_${i} 2>&1 - done diff --git a/sci-chemistry/apbs/files/apbs-gcc4-gentoo.patch b/sci-chemistry/apbs/files/apbs-gcc4-gentoo.patch deleted file mode 100644 index 434a7fc0a05c..000000000000 --- a/sci-chemistry/apbs/files/apbs-gcc4-gentoo.patch +++ /dev/null @@ -1,20 +0,0 @@ ---- apbs-0.4.0/configure 2005-12-14 14:11:17.000000000 -0500 -+++ apbs-0.4.0-new/configure 2006-05-23 17:01:07.000000000 -0400 -@@ -3513,7 +3513,7 @@ - ac_link='$F77 -o conftest$ac_exeext $FFLAGS $LDFLAGS conftest.$ac_ext $LIBS >&5' - ac_compiler_gnu=$ac_cv_f77_compiler_gnu - if test -n "$ac_tool_prefix"; then -- for ac_prog in g77 f77 xlf frt pgf77 fl32 af77 fort77 f90 xlf90 pgf90 epcf90 f95 fort xlf95 lf95 g95 -+ for ac_prog in g77 gfortran f77 xlf frt pgf77 fl32 af77 fort77 f90 xlf90 pgf90 epcf90 f95 fort xlf95 lf95 g95 - do - # Extract the first word of "$ac_tool_prefix$ac_prog", so it can be a program name with args. - set dummy $ac_tool_prefix$ac_prog; ac_word=$2 -@@ -3555,7 +3555,7 @@ - fi - if test -z "$F77"; then - ac_ct_F77=$F77 -- for ac_prog in g77 f77 xlf frt pgf77 fl32 af77 fort77 f90 xlf90 pgf90 epcf90 f95 fort xlf95 lf95 g95 -+ for ac_prog in g77 gfortran f77 xlf frt pgf77 fl32 af77 fort77 f90 xlf90 pgf90 epcf90 f95 fort xlf95 lf95 g95 - do - # Extract the first word of "$ac_prog", so it can be a program name with args. - set dummy $ac_prog; ac_word=$2 diff --git a/sci-chemistry/apbs/metadata.xml b/sci-chemistry/apbs/metadata.xml index dafc7c94643e..cc7f93f699b0 100644 --- a/sci-chemistry/apbs/metadata.xml +++ b/sci-chemistry/apbs/metadata.xml @@ -6,4 +6,7 @@ <name>Markus Dittrich</name> </maintainer> <herd>sci-chemistry</herd> + <use> + <flag name='arpack'>Include support for arpack libs</flag> + </use> </pkgmetadata> |