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path: root/sci-chemistry
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* sci-chemistry/reduce: Allow for compiling with GCC 6David Seifert2016-09-203-11/+24
| | | | | | | | Gentoo-bug: 594202 * EAPI=6 * Make PATCHES -p1 compliant Package-Manager: portage-2.3.1
* sci-chemistry/gelemental: Allow for compiling with GCC 6David Seifert2016-09-172-1/+16
| | | | | | Gentoo-bug: 593994 Package-Manager: portage-2.3.0
* sci-chemistry/gromacs: fix build with mkl (bug #592786)Christoph Junghans2016-09-032-2/+14
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/gromacs: add missing test depChristoph Junghans2016-08-251-1/+4
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/gromacs: fix sandbox issue (bug #591952)Christoph Junghans2016-08-233-3/+9
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/votca-csgapps: version bumpChristoph Junghans2016-08-192-0/+33
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/votca-csg: version bumpChristoph Junghans2016-08-192-0/+117
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/gromacs: remove oldChristoph Junghans2016-08-173-557/+0
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/gromacs: re-enable testing (bug #591174)Christoph Junghans2016-08-174-8/+8
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/massxpert: Cleanup per bug #146900Pacho Ramos2016-08-061-4/+0
| | | | Package-Manager: portage-2.3.0
* sci-chemistry/jmol: Cleanup per bug #146900Pacho Ramos2016-08-061-4/+0
| | | | Package-Manager: portage-2.3.0
* sci-chemistry/gtk-gamess: Cleanup per bug #146900Pacho Ramos2016-08-061-4/+0
| | | | Package-Manager: portage-2.3.0
* sci-chemistry/chemical-mime-data: Cleanup per bug #146900Pacho Ramos2016-08-061-4/+0
| | | | Package-Manager: portage-2.3.0
* sci-chemistry/gromacs: add release 2016Alexey Shvetsov2016-08-052-2/+2
| | | | Package-Manager: portage-2.3.0
* sourceforge: switch to https:// URIsMike Frysinger2016-07-277-7/+7
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* sci-chemistry/gromacs: Version bumpAlexey Shvetsov2016-07-252-0/+271
| | | | Package-Manager: portage-2.3.0
* sci-chemistry/chemical-mime-data: Drop unecessary or unfunctional depsJustin Lecher2016-07-201-5/+1
| | | | | Package-Manager: portage-2.3.0 Signed-off-by: Justin Lecher <jlec@gentoo.org>
* sci-chemistry/GromacsWrapper: Version bumpAlexey Shvetsov2016-07-192-0/+38
| | | | Package-Manager: portage-2.3.0
* sci-chemistry/gromacs: update live ebuildChristoph Junghans2016-07-172-2/+2
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/votca-csgapps: import live ebuild from sciChristoph Junghans2016-07-141-0/+32
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/votca-csgapps: fix depsChristoph Junghans2016-07-141-1/+1
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/votca-csg: import live ebuild from sciChristoph Junghans2016-07-141-0/+114
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/votca-csg: fix cmake-3.4 build (bug #588834)Christoph Junghans2016-07-142-4/+67
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/gromacs: import live builds from sci overlayChristoph Junghans2016-07-138-1/+1618
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/gromacs: sync with sci overlay (bug #588648)Christoph Junghans2016-07-121-9/+9
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/gromacs: Add my as maintainerAlexey Shvetsov2016-07-111-0/+4
| | | | Package-Manager: portage-2.3.0
* sci-chemistry/gromacs: Clean up old versionAlexey Shvetsov2016-07-116-1398/+0
| | | | Package-Manager: portage-2.3.0
* sci-chemistry/gromacs: Version bumpAlexey Shvetsov2016-07-112-0/+271
| | | | Package-Manager: portage-2.3.0
* sci-chemistry/chemical-mime-data: add ~arm keywordMichael Palimaka2016-07-081-1/+1
| | | | | | Tested on Raspberry Pi 2. Package-Manager: portage-2.3.0
* sci-chemistry/ball: Fix Swig bug, qualify std::isnanDavid Seifert2016-06-055-14/+133
| | | | | | | | | | | Gentoo-Bug: 583932 * EAPI=6 * Also fix GCC warning pollution due to misplaced attributes * Add subslot operator for dev-libs/boost * Remove USE=webkit, as webkit is no longer supported Package-Manager: portage-2.3.0_rc1
* sci-chemistry/acpype: remove oldDavid Seifert2016-05-153-78/+0
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/votca-csg: Fix QA MissingSlotDepDavid Seifert2016-05-151-3/+3
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/povscript+: Fix QA MissingSlotDepDavid Seifert2016-05-151-3/+3
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/molmol: Fix QA MissingSlotDepDavid Seifert2016-05-151-2/+2
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/molmol: Fix QA MissingSlotDepDavid Seifert2016-05-151-2/+2
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/aria: Fix QA MissingSlotDepDavid Seifert2016-05-151-2/+2
| | | | Package-Manager: portage-2.2.28
* fix <pkg/> reference in metadata.xmlIan Stakenvicius2016-04-191-1/+1
| | | | Package-Manager: portage-2.2.26
* sci-chemistry/avogadro: Fix BOOST_JOIN with >=dev-libs/boost-1.58.0David Seifert2016-04-032-7/+86
| | | | | | | Gentoo-Bug: 578896 * EAPI=6 Package-Manager: portage-2.2.28
* sci-chemistry/icm: drop myself from metadata.xmlAlexey Shvetsov2016-03-311-4/+0
| | | | Package-Manager: portage-2.2.28
* sci-chemistry/chemical-mime-data: Add missing png&svg support for ↵Justin Lecher2016-03-291-0/+49
| | | | | | | | | | | | | imagemagick during build * Bump to EAPI=6 * Use xdg.eclass instead of fdo-mime.eclass * Optional usage of gnome-base/librsvg instead of media-gfx/imagemagick Gentoo-Bug: https://bugs.gentoo.org/show_bug.cgi?id=575904 Package-Manager: portage-2.2.27 Signed-off-by: Justin Lecher <jlec@gentoo.org>
* sci-chemistry/chemical-mime-data: x86 stable wrt bug #575912Agostino Sarubbo2016-03-151-1/+1
| | | | | | Package-Manager: portage-2.2.26 RepoMan-Options: --include-arches="x86" Signed-off-by: Agostino Sarubbo <ago@gentoo.org>
* sci-chemistry/chemical-mime-data: amd64 stable wrt bug #575912Agostino Sarubbo2016-03-151-1/+1
| | | | | | Package-Manager: portage-2.2.26 RepoMan-Options: --include-arches="amd64" Signed-off-by: Agostino Sarubbo <ago@gentoo.org>
* Drop sci-chemistry/pymol-apbs-pluginJustin Lecher2016-02-228-474/+0
| | | | Signed-off-by: Justin Lecher <jlec@gentoo.org>
* Remove masked for removal packagesPacho Ramos2016-02-208-419/+0
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* sci-chemistry/coot: Chop DESCRIPTION to 80 charsJustin Lecher2016-02-142-3/+3
| | | | | Package-Manager: portage-2.2.27 Signed-off-by: Justin Lecher <jlec@gentoo.org>
* sci-chemistry/molden: Version BumpJustin Lecher2016-02-112-0/+76
| | | | | | | Gentoo-Bug: https://bugs.gentoo.org/show_bug.cgi?id=509854 Package-Manager: portage-2.2.27 Signed-off-by: Justin Lecher <jlec@gentoo.org>
* sci-chemistry/molden: Fix SRC_URI to new locationJustin Lecher2016-02-112-2/+2
| | | | | | | Gentoo-Bug: https://bugs.gentoo.org/show_bug.cgi?id=509854 Package-Manager: portage-2.2.27 Signed-off-by: Justin Lecher <jlec@gentoo.org>
* sci-chemistry/molden: Fix HOMEPAGE to new locationJustin Lecher2016-02-112-4/+4
| | | | | | | Gentoo-Bug: https://bugs.gentoo.org/show_bug.cgi?id=509854 Package-Manager: portage-2.2.27 Signed-off-by: Justin Lecher <jlec@gentoo.org>
* sci-chemistry/psi: Chop DESCRIPTION to 80 charsJustin Lecher2016-02-091-1/+1
| | | | | Package-Manager: portage-2.2.27 Signed-off-by: Justin Lecher <jlec@gentoo.org>
* sci-chemistry/psi: Fix multiple build failuresJustin Lecher2016-02-092-3/+41
| | | | | | | | | | | | * Use byacc instead of bison * Depend on correct SLOT of libint * Fix format-security problems Gentoo-Bug: https://bugs.gentoo.org/show_bug.cgi?id=430588 Gentoo-Bug: https://bugs.gentoo.org/show_bug.cgi?id=574068 Package-Manager: portage-2.2.27 Signed-off-by: Justin Lecher <jlec@gentoo.org>