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authorJustin Lecher <jlec@gentoo.org>2013-06-30 17:31:13 +0200
committerJustin Lecher <jlec@gentoo.org>2013-06-30 17:31:13 +0200
commit871dd6c9683391d6caedb0c82efac78e8befd55c (patch)
treeb0ea10fb7ce72d9d8f829e74e875bc6e1b8fb269 /sci-chemistry
parentMerge pull request #85 from ercpe/jlec (diff)
parentsci-libs/msms: Version BUmp; Bump to new distutil-r1.eclass (diff)
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Merge branch 'master' into jlec
* master: (36 commits) sci-libs/msms: Version BUmp; Bump to new distutil-r1.eclass app-doc/root-docs: version bump sci-physics/root: version bump sys-cluster/hpl: version bump and fixes fixed deps In sci-libs/bigdft-abi-1.0.4-r1, CUDA support made compile. moved to gx86 moved to gx86 Beautify Beautify Beautify. Added new package: projections Added new package: projections Bashified package name mangling. sys-cluster/modules: Prefix keyworded. Added tests. FHS fixes. Add bunch of fedora patches Fixed missing use flag. sci-chemistry/ucsf-tools: Fix compilation with latest gcc sci-chemistry/modeller: Fix lib position, #474696 sci-chemistry/pymol: Update repo uri sci-chemistry/pymol: Update repo uri ...
Diffstat (limited to 'sci-chemistry')
-rw-r--r--sci-chemistry/ambertools/ChangeLog4
-rw-r--r--sci-chemistry/ambertools/ambertools-12.ebuild2
-rw-r--r--sci-chemistry/gnome-chemistry-utils/ChangeLog4
-rw-r--r--sci-chemistry/gnome-chemistry-utils/gnome-chemistry-utils-0.14.2.ebuild2
-rw-r--r--sci-chemistry/gnome-chemistry-utils/metadata.xml8
-rw-r--r--sci-chemistry/modeller/ChangeLog4
-rw-r--r--sci-chemistry/modeller/modeller-9.12-r2.ebuild (renamed from sci-chemistry/modeller/modeller-9.12-r1.ebuild)3
-rw-r--r--sci-chemistry/pymol/ChangeLog3
-rw-r--r--sci-chemistry/pymol/pymol-9999.ebuild2
-rw-r--r--sci-chemistry/ucsf-tools/ChangeLog3
-rw-r--r--sci-chemistry/ucsf-tools/ucsf-tools-9999.ebuild13
11 files changed, 38 insertions, 10 deletions
diff --git a/sci-chemistry/ambertools/ChangeLog b/sci-chemistry/ambertools/ChangeLog
index f4d3a9da3..c46b0af1f 100644
--- a/sci-chemistry/ambertools/ChangeLog
+++ b/sci-chemistry/ambertools/ChangeLog
@@ -2,6 +2,9 @@
# Copyright 1999-2013 Gentoo Foundation; Distributed under the GPL v2
# $Header: /var/cvsroot/gentoo-x86/sci-chemistry/ambertools/ChangeLog,v 1.2 2011/08/02 14:42:37 alexxy Exp $
+ 28 Jun 2013; Christoph Junghans <ottxor@gentoo.org> ambertools-12.ebuild:
+ fixed deps
+
03 Mar 2013; Justin Lecher <jlec@gentoo.org> ambertools-1.5-r4.ebuild:
Add missing multilib.eclass
@@ -69,4 +72,3 @@
28 Jul 2011; Alexey Shvetsov <alexxy@gentoo.org> +ambertools-1.5-r1.ebuild,
+files/ambertools-1.5-gentoo.patch, +metadata.xml:
Initial import to tree
-
diff --git a/sci-chemistry/ambertools/ambertools-12.ebuild b/sci-chemistry/ambertools/ambertools-12.ebuild
index 70ea7f3c3..83242962d 100644
--- a/sci-chemistry/ambertools/ambertools-12.ebuild
+++ b/sci-chemistry/ambertools/ambertools-12.ebuild
@@ -26,7 +26,7 @@ RDEPEND="
sci-libs/cifparse-obj
sci-chemistry/mopac7
sci-libs/netcdf
- sci-libs/fftw:3.0
+ >=sci-libs/fftw-3.3:3.0
sci-chemistry/reduce"
DEPEND="${RDEPEND}
app-shells/tcsh
diff --git a/sci-chemistry/gnome-chemistry-utils/ChangeLog b/sci-chemistry/gnome-chemistry-utils/ChangeLog
index b71a1a2f3..f45e5bf6a 100644
--- a/sci-chemistry/gnome-chemistry-utils/ChangeLog
+++ b/sci-chemistry/gnome-chemistry-utils/ChangeLog
@@ -2,6 +2,10 @@
# Copyright 1999-2013 Gentoo Foundation; Distributed under the GPL v2
# $Header: $
+ 21 Jun 2013; Justin Lecher <jlec@gentoo.org>
+ gnome-chemistry-utils-0.14.2.ebuild, metadata.xml:
+ Fix min version of openbabel
+
06 Apr 2013; Karl Linden (lilrc) <lilrc@users.sourceforge.net>
gnome-chemistry-utils-0.14.2.ebuild:
Migrate to gnome2 eclass.
diff --git a/sci-chemistry/gnome-chemistry-utils/gnome-chemistry-utils-0.14.2.ebuild b/sci-chemistry/gnome-chemistry-utils/gnome-chemistry-utils-0.14.2.ebuild
index cbaeea866..e0d8c6a23 100644
--- a/sci-chemistry/gnome-chemistry-utils/gnome-chemistry-utils-0.14.2.ebuild
+++ b/sci-chemistry/gnome-chemistry-utils/gnome-chemistry-utils-0.14.2.ebuild
@@ -23,7 +23,7 @@ RDEPEND="
>=gnome-extra/libgsf-1.14.9
>=sci-chemistry/bodr-5
>=sci-chemistry/chemical-mime-data-0.1.94
- >=sci-chemistry/openbabel-2.1.0
+ >=sci-chemistry/openbabel-2.3.0
>=x11-libs/cairo-1.6.0
>=x11-libs/gdk-pixbuf-2.22.0
>=x11-libs/goffice-0.10.0
diff --git a/sci-chemistry/gnome-chemistry-utils/metadata.xml b/sci-chemistry/gnome-chemistry-utils/metadata.xml
index 5a8da44f4..94e01b4a7 100644
--- a/sci-chemistry/gnome-chemistry-utils/metadata.xml
+++ b/sci-chemistry/gnome-chemistry-utils/metadata.xml
@@ -1,11 +1,11 @@
<?xml version="1.0" encoding="UTF-8"?>
<!DOCTYPE pkgmetadata SYSTEM "http://www.gentoo.org/dtd/metadata.dtd">
<pkgmetadata>
- <longdescription lang="en">
+ <longdescription lang="en">
The Gnome Chemistry Utils provide some programs and library containing
GTK widgets and some C++ classes related to chemistry.
</longdescription>
- <use>
- <flag name="gnumeric">Build pluging for gnumeric</flag>
- </use>
+ <use>
+ <flag name="gnumeric">Build pluging for gnumeric</flag>
+ </use>
</pkgmetadata>
diff --git a/sci-chemistry/modeller/ChangeLog b/sci-chemistry/modeller/ChangeLog
index 2817f00e5..cedd72b92 100644
--- a/sci-chemistry/modeller/ChangeLog
+++ b/sci-chemistry/modeller/ChangeLog
@@ -2,6 +2,10 @@
# Copyright 1999-2013 Gentoo Foundation; Distributed under the GPL v2
# $Header: $
+ 26 Jun 2013; Justin Lecher <jlec@gentoo.org> -modeller-9.12-r1.ebuild,
+ +modeller-9.12-r2.ebuild:
+ Fix lib position, #474696
+
*modeller-9.12-r1 (18 Jun 2013)
18 Jun 2013; Justin Lecher <jlec@gentoo.org> -modeller-9.12.ebuild,
diff --git a/sci-chemistry/modeller/modeller-9.12-r1.ebuild b/sci-chemistry/modeller/modeller-9.12-r2.ebuild
index a25aa7fae..9cfd2e3d3 100644
--- a/sci-chemistry/modeller/modeller-9.12-r1.ebuild
+++ b/sci-chemistry/modeller/modeller-9.12-r2.ebuild
@@ -7,7 +7,7 @@ EAPI=5
PYTHON_COMPAT=( python{2_6,2_7,3_2,3_3} )
PYTHON_COMPAT=( python{2_6,2_7} )
-inherit distutils-r1 eutils versionator
+inherit distutils-r1 eutils multilib versionator
DESCRIPTION="Homology or comparative modeling of protein three-dimensional structures"
HOMEPAGE="http://salilab.org/modeller/"
@@ -83,6 +83,7 @@ python_install_all(){
exeinto ${INPATH}/lib/${EXECTYPE}/
doexe lib/${EXECTYPE}/lib*
dosym libmodeller.so.8 ${INPATH}/lib/${EXECTYPE}/libmodeller.so
+ dosym ../../${INPATH}/lib/${EXECTYPE}/libmodeller.so.8 /usr/$(get_libdir)/libmodeller.so.8
use doc && HTML_DOCS=( doc/. )
distutils-r1_python_install_all
diff --git a/sci-chemistry/pymol/ChangeLog b/sci-chemistry/pymol/ChangeLog
index f5e0f9b41..80bd47e8c 100644
--- a/sci-chemistry/pymol/ChangeLog
+++ b/sci-chemistry/pymol/ChangeLog
@@ -2,6 +2,9 @@
# Copyright 1999-2013 Gentoo Foundation; Distributed under the GPL v2
# $Header: $
+ 26 Jun 2013; Justin Lecher <jlec@gentoo.org> pymol-9999.ebuild:
+ Update repo uri
+
25 Mar 2013; Justin Lecher <jlec@gentoo.org> pymol-9999.ebuild, metadata.xml:
Sync with tree
diff --git a/sci-chemistry/pymol/pymol-9999.ebuild b/sci-chemistry/pymol/pymol-9999.ebuild
index 564732c2f..57b5715bd 100644
--- a/sci-chemistry/pymol/pymol-9999.ebuild
+++ b/sci-chemistry/pymol/pymol-9999.ebuild
@@ -12,7 +12,7 @@ inherit distutils-r1 fdo-mime subversion versionator
DESCRIPTION="A Python-extensible molecular graphics system"
HOMEPAGE="http://pymol.sourceforge.net/"
SRC_URI="http://dev.gentoo.org/~jlec/distfiles/${PN}-icons.tar.xz"
-ESVN_REPO_URI="https://pymol.svn.sourceforge.net/svnroot/pymol/trunk/pymol"
+ESVN_REPO_URI="svn://svn.code.sf.net/p/pymol/code/trunk/pymol"
LICENSE="PSF-2.2"
SLOT="0"
diff --git a/sci-chemistry/ucsf-tools/ChangeLog b/sci-chemistry/ucsf-tools/ChangeLog
index 758f3fd1d..397511d37 100644
--- a/sci-chemistry/ucsf-tools/ChangeLog
+++ b/sci-chemistry/ucsf-tools/ChangeLog
@@ -2,6 +2,9 @@
# Copyright 1999-2013 Gentoo Foundation; Distributed under the GPL v2
# $Header: $
+ 26 Jun 2013; Justin Lecher <jlec@gentoo.org> ucsf-tools-9999.ebuild:
+ Fix compilation with latest gcc
+
23 Apr 2013; Justin Lecher <jlec@gentoo.org> ucsf-tools-9999.ebuild,
metadata.xml:
Fix metadata, #466774; bump EAPI; set restricter license
diff --git a/sci-chemistry/ucsf-tools/ucsf-tools-9999.ebuild b/sci-chemistry/ucsf-tools/ucsf-tools-9999.ebuild
index bacdbce91..127745d4b 100644
--- a/sci-chemistry/ucsf-tools/ucsf-tools-9999.ebuild
+++ b/sci-chemistry/ucsf-tools/ucsf-tools-9999.ebuild
@@ -6,7 +6,7 @@ EAPI=5
AUTOTOOLS_AUTORECONF=y
-inherit autotools-utils
+inherit autotools-utils flag-o-matic
DESCRIPTION="The USF program suite"
HOMEPAGE="http://xray.bmc.uu.se/usf/"
@@ -30,3 +30,14 @@ src_unpack() {
cd "${S}"
unpack mark-20110912.tgz
}
+
+src_prepare() {
+ local src
+ append-fflags -ffixed-line-length-132
+ for src in \
+ ave coma comap comdem dataman essens imp lsqman mama mapfix \
+ mapman mave ncs6d o2d prof solex spancsi; do
+ mv ${src}/${src}.{f,F} || die
+ done
+ autotools-utils_src_prepare
+}