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path: root/sci-chemistry/gamess
Commit message (Expand)AuthorAgeFilesLines
* whitespaceAlexey Shvetsov2009-04-231-4/+4
* whitespaceAlexey Shvetsov2009-04-231-2/+2
* Add support of adjusting MM size at build time for GAMESS-USAlexey Shvetsov2009-04-231-5/+5
* Add support of adjusting MM size at build time for GAMESS-USAlexey Shvetsov2009-04-232-2/+23
* Add QM/MM support to GAMESS-USAlexey Shvetsov2009-04-221-6/+8
* Add QM/MM support to GAMESS-USAlexey Shvetsov2009-04-223-1/+244
* GAMESS version bumpAlexey Shvetsov2009-02-201-2/+15
* GAMESS version bumpAlexey Shvetsov2009-02-204-2/+590
* Made slight change to rungms script to allow parallel runs via environmental ...Markus Dittrich2008-10-121-12/+2
* Made slight change to rungms script to allow parallel runs via environmental ...Markus Dittrich2008-10-122-15/+49
* Add missing die: || "..." -> || die "..."Torsten Veller2008-06-291-8/+8
* Add missing die: || "..." -> || die "..."Torsten Veller2008-06-295-13/+18
* 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 Dittrich2008-05-101-0/+1
* Also re-added patch required for previously removed version.Markus Dittrich2008-05-101-0/+222
* Re-added accidentally removed stable version.Markus Dittrich2008-05-101-1/+3
* Re-added accidentally removed stable version.Markus Dittrich2008-05-102-1/+219
* Version bump (fixes bug #220855).Markus Dittrich2008-05-081-7/+4
* Version bump (fixes bug #220855).Markus Dittrich2008-05-086-676/+370
* Version bumpMarkus Dittrich2008-03-181-4/+6
* Version bumpMarkus Dittrich2008-03-185-14/+231
* Remove all old-style digests from the system and regen the Manifest files.Robin H. Johnson2008-01-314-42/+0
* whitespaceMichael Sterrett2007-10-271-4/+4
* whitespaceMichael Sterrett2007-10-271-2/+2
* Version bump and keyworded gamess for amd64. An external blas library is now ...Markus Dittrich2007-10-271-4/+16
* Version bump and keyworded gamess for amd64. An external blas library is now ...Markus Dittrich2007-10-274-1/+561
* Fixed bad RDEPEND.Markus Dittrich2007-08-191-12/+12
* Fixed bad RDEPEND.Markus Dittrich2007-08-193-5/+9
* whitespaceMichael Sterrett2007-07-131-18/+8
* whitespaceMichael Sterrett2007-07-132-4/+2
* stable x86, bug 183881Christian Faulhammer2007-07-031-8/+18
* stable x86, bug 183881Christian Faulhammer2007-07-032-3/+7
* whitespaceMichael Sterrett2007-06-261-8/+8
* whitespaceMichael Sterrett2007-06-262-6/+6
* Version bump and cleaned up unused patches.Markus Dittrich2007-04-171-34/+16
* Version bump and cleaned up unused patches.Markus Dittrich2007-04-178-272/+297
* 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 Dittrich2006-12-141-4/+16
* Version bump. This version includes the NEO code.Markus Dittrich2006-12-144-1/+448
* 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 Dittrich2006-06-301-8/+8
* Changed the ebuild to provide the test scripts used to validate the gamess te...Markus Dittrich2006-06-302-13/+18
* Disable linking against external blas when compiling with ifc and print out a...Markus Dittrich2006-06-231-8/+8
* Disable linking against external blas when compiling with ifc and print out a...Markus Dittrich2006-06-232-4/+12
* Removed ifc use flag and replaced it with fortran.eclass logicMarkus Dittrich2006-05-231-22/+22