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path: root/sci-chemistry/gamess
Commit message (Expand)AuthorAgeFilesLines
* [sci-chemistry/gamess] make it build with new buildsystemAlexey Shvetsov2010-05-304-31/+433
* [sci-chemistry/gamess] Fix typoAlexey Shvetsov2010-05-243-14/+9
* [sci-chemistry/gamess] Version bump. Also this version has improved qmmm supportAlexey Shvetsov2010-05-243-3/+336
* whitespaceMichael Sterrett2009-11-302-13/+3
* [sci-chemistry/gamess] Fix typo and add note about mpiAlexey Shvetsov2009-11-303-8/+21
* [sci-chemistry/gamess] Enable mpi build for gamess-us. It's usefull if you ha...Alexey Shvetsov2009-11-303-2/+298
* Stable on ppc.Mounir Lamouri2009-11-073-5/+9
* Version bump and removed old ebuilds.Markus Dittrich2009-10-237-1018/+70
* Use elog for fetch error.Diego Elio Pettenò2009-07-071-5/+5
* Use elog for fetch error.Diego Elio Pettenò2009-07-072-9/+13
* amd64 stable, bug #268848Markus Meier2009-05-233-8/+11
* stable x86, bug 268848Christian Faulhammer2009-05-153-8/+12
* whitespaceAlexey Shvetsov2009-04-232-6/+6
* Add support of adjusting MM size at build time for GAMESS-USAlexey Shvetsov2009-04-233-7/+28
* Add QM/MM support to GAMESS-USAlexey Shvetsov2009-04-224-7/+252
* GAMESS version bumpAlexey Shvetsov2009-02-205-4/+605
* Made slight change to rungms script to allow parallel runs via environmental ...Markus Dittrich2008-10-123-27/+51
* Add missing die: || "..." -> || die "..."Torsten Veller2008-06-296-21/+26
* revert stable KEYWORDS because the tarball is restricted and old ones won't b...Christian Faulhammer2008-05-111-2/+12
* revert stable KEYWORDS because the tarball is restricted and old ones won't b...Christian Faulhammer2008-05-112-3/+8
* Also re-added patch required for previously removed version.Markus Dittrich2008-05-102-0/+223
* Re-added accidentally removed stable version.Markus Dittrich2008-05-103-2/+222
* Version bump (fixes bug #220855).Markus Dittrich2008-05-087-683/+374
* Version bumpMarkus Dittrich2008-03-186-18/+237
* Remove all old-style digests from the system and regen the Manifest files.Robin H. Johnson2008-01-314-42/+0
* whitespaceMichael Sterrett2007-10-272-6/+6
* Version bump and keyworded gamess for amd64. An external blas library is now ...Markus Dittrich2007-10-275-5/+577
* Fixed bad RDEPEND.Markus Dittrich2007-08-194-17/+21
* whitespaceMichael Sterrett2007-07-131-18/+8
* whitespaceMichael Sterrett2007-07-132-4/+2
* stable x86, bug 183881Christian Faulhammer2007-07-033-11/+25
* whitespaceMichael Sterrett2007-06-261-8/+8
* whitespaceMichael Sterrett2007-06-262-6/+6
* Version bump and cleaned up unused patches.Markus Dittrich2007-04-179-306/+313
* QA: Removed unused versions.Danny van Dyk2007-01-075-482/+14
* QA: Removed unused versions.Danny van Dyk2007-01-071-2/+6
* Version bump. This version includes the NEO code.Markus Dittrich2006-12-145-5/+464
* Version bump (see bug #149118). Also removed one old ebuild and its accompany...Markus Dittrich2006-09-269-455/+16
* Version bump (see bug #149118). Also removed one old ebuild and its accompany...Markus Dittrich2006-09-264-1/+428
* (#148281) Change herd to sci-chemistry from sci.Donnie Berkholz2006-09-201-8/+8
* (#148281) Change herd to sci-chemistry from sci.Donnie Berkholz2006-09-202-2/+5
* Changed the ebuild to provide the test scripts used to validate the gamess te...Markus Dittrich2006-06-303-21/+26
* Disable linking against external blas when compiling with ifc and print out a...Markus Dittrich2006-06-233-12/+20
* Removed ifc use flag and replaced it with fortran.eclass logicMarkus Dittrich2006-05-233-48/+45
* Convert leading spaces to tabs.Donnie Berkholz2006-05-144-23/+27
* Keyword ~ppc. Also make sure to strip -malign-double on non-x86 systems.Donnie Berkholz2006-05-143-15/+40
* Added patch to fix missing CLK_TCK with glibc-2.4.Markus Dittrich2006-03-284-8/+60
* Version bump and changed the ebuild naming convention to start with the year...Markus Dittrich2006-03-2313-589/+208
* Made ebuild ready to compile and run properly using gfortran.Markus Dittrich2006-02-084-16/+83
* Fixed improper digest. This resolves bug #119994.Markus Dittrich2006-01-233-4/+8