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path: root/sci-chemistry
Commit message (Collapse)AuthorAgeFilesLines
* nmrpipe goneSamuli Suominen2008-12-215-257/+0
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* Fix bug 250420 thanks to Joel <joel_123@hotmail.com>Peter Alfredsen2008-12-191-2/+3
| | | | | (Portage version: 2.2_rc17/cvs/Linux 2.6.28-rc6 x86_64) (Unsigned Manifest commit)
* Fix bug 250420 thanks to Joel <joel_123@hotmail.com>Peter Alfredsen2008-12-193-6/+67
| | | | (Portage version: 2.2_rc17/cvs/Linux 2.6.28-rc6 x86_64)
* Rename patchesJeffrey Gardner2008-12-191-3/+3
| | | | | (Portage version: 2.1.6.1/cvs/Linux 2.6.27-gentoo-r6 x86_64) (Unsigned Manifest commit)
* Rename patchesJeffrey Gardner2008-12-193-1/+4
| | | | (Portage version: 2.1.6.1/cvs/Linux 2.6.27-gentoo-r6 x86_64)
* Bump to fix compilation and use moved svn repository. Thanks to jlec on IRC.Jeffrey Gardner2008-12-191-2/+2
| | | | | (Portage version: 2.1.6.1/cvs/Linux 2.6.27-gentoo-r6 x86_64) (Unsigned Manifest commit)
* Bump to fix compilation and use moved svn repository. Thanks to jlec on IRC.Jeffrey Gardner2008-12-192-4/+11
| | | | (Portage version: 2.1.6.1/cvs/Linux 2.6.27-gentoo-r6 x86_64)
* Fixing file collision with sci-visualization/extrema, bug #249423.Andrey Grozin2008-12-071-3/+3
| | | | | (Portage version: 2.2_rc17/cvs/Linux 2.6.26-tuxonice i686) (Unsigned Manifest commit)
* Fixing file collision with sci-visualization/extrema, bug #249423.Andrey Grozin2008-12-073-6/+14
| | | | (Portage version: 2.2_rc17/cvs/Linux 2.6.26-tuxonice i686)
* Incorporating #includes to fix gcc4.3 issues.Jeffrey Gardner2008-11-301-2/+3
| | | | | (Portage version: 2.1.6_rc2/cvs/Linux 2.6.27-gentoo-r4 x86_64) (Unsigned Manifest commit)
* Incorporating #includes to fix gcc4.3 issues.Jeffrey Gardner2008-11-303-2/+26
| | | | (Portage version: 2.1.6_rc2/cvs/Linux 2.6.27-gentoo-r4 x86_64)
* Fixing this so it can actually work. Sorry.Patrick Lauer2008-11-281-2/+2
| | | | | (Portage version: 2.2_rc16/cvs/Linux 2.6.26.5 x86_64) (Unsigned Manifest commit)
* Fixing this so it can actually work. Sorry.Patrick Lauer2008-11-282-3/+8
| | | | (Portage version: 2.2_rc16/cvs/Linux 2.6.26.5 x86_64)
* Bump to 2.98Patrick Lauer2008-11-271-11/+3
| | | | | (Portage version: 2.2_rc16/cvs/Linux 2.6.26.5 x86_64) (Unsigned Manifest commit)
* Bump to 2.98Patrick Lauer2008-11-272-1/+66
| | | | (Portage version: 2.2_rc16/cvs/Linux 2.6.26.5 x86_64)
* Bump to 1.14Patrick Lauer2008-11-271-1/+3
| | | | | (Portage version: 2.2_rc16/cvs/Linux 2.6.26.5 x86_64) (Unsigned Manifest commit)
* Bump to 1.14Patrick Lauer2008-11-272-1/+70
| | | | (Portage version: 2.2_rc16/cvs/Linux 2.6.26.5 x86_64)
* Re-assign to sci-chemistry herd.Samuli Suominen2008-11-241-2/+2
| | | | | (Portage version: 2.2_rc15/cvs/Linux 2.6.27-gentoo-r3 i686) (Unsigned Manifest commit)
* Re-assign to sci-chemistry herd.Samuli Suominen2008-11-242-5/+5
| | | | (Portage version: 2.2_rc15/cvs/Linux 2.6.27-gentoo-r3 i686)
* Restrict fltk to 1.1 slot since vmd is not fltk-2 ready (see bug #246445). ↵Markus Dittrich2008-11-121-4/+2
| | | | | | | Removed old ebuild. (Portage version: 2.2_rc13/cvs/Linux 2.6.27-SENTINEL-2 i686) (Unsigned Manifest commit)
* Restrict fltk to 1.1 slot since vmd is not fltk-2 ready (see bug #246445). ↵Markus Dittrich2008-11-123-153/+10
| | | | | | Removed old ebuild. (Portage version: 2.2_rc13/cvs/Linux 2.6.27-SENTINEL-2 i686)
* Fix quoting.Donnie Berkholz2008-11-071-6/+6
| | | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.28-rc3 x86_64) (Signed Manifest commit)
* Fix quoting.Donnie Berkholz2008-11-073-8/+12
| | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.28-rc3 x86_64)
* Add OpenMP support.Donnie Berkholz2008-11-071-5/+7
| | | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.28-rc3 x86_64) (Signed Manifest commit)
* Add OpenMP support.Donnie Berkholz2008-11-072-1/+85
| | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.28-rc3 x86_64)
* (#245504) This ebuild was wrongly updated for the blackdown removal, which ↵Donnie Berkholz2008-11-061-2/+12
| | | | | | | broke it. Fix that. (Portage version: 2.2_rc12/cvs/Linux 2.6.28-rc3 x86_64) (Signed Manifest commit)
* (#245504) This ebuild was wrongly updated for the blackdown removal, which ↵Donnie Berkholz2008-11-062-3/+7
| | | | | | broke it. Fix that. (Portage version: 2.2_rc12/cvs/Linux 2.6.28-rc3 x86_64)
* Add ppc64 love for KDE 4.Mike Frysinger2008-11-021-2/+12
| | | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.26.2 x86_64) (Signed Manifest commit)
* Add ppc64 love for KDE 4.Mike Frysinger2008-11-022-11/+16
| | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.26.2 x86_64)
* Added new and significantly cleaned up revision which also fixes ↵Markus Dittrich2008-10-191-2/+4
| | | | | | | pre-stripping and LDFLAGS issues (see bug #241184). (Portage version: 2.2_rc12/cvs/Linux 2.6.26-SENTINEL-3 i686) (Unsigned Manifest commit)
* Added new and significantly cleaned up revision which also fixes ↵Markus Dittrich2008-10-194-10/+88
| | | | | | pre-stripping and LDFLAGS issues (see bug #241184). (Portage version: 2.2_rc12/cvs/Linux 2.6.26-SENTINEL-3 i686)
* Fixed gcc-4.3 issues (see bug #239567).Markus Dittrich2008-10-191-12/+3
| | | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.26-SENTINEL-3 i686) (Unsigned Manifest commit)
* Fixed gcc-4.3 issues (see bug #239567).Markus Dittrich2008-10-193-3/+26
| | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.26-SENTINEL-3 i686)
* smp USE-flag is global nowMarkus Meier2008-10-171-5/+5
| | | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.27.1 i686) (Signed Manifest commit)
* smp USE-flag is global nowMarkus Meier2008-10-172-4/+4
| | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.27.1 i686)
* openmp USE-flag is global nowMarkus Meier2008-10-171-5/+5
| | | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.27.1 i686) (Signed Manifest commit)
* openmp USE-flag is global nowMarkus Meier2008-10-172-4/+4
| | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.27.1 i686)
* Added -ffixed-line-length-132 to FFLAGS to avoid gcc-4.1.2 errors due to ↵Markus Dittrich2008-10-161-13/+3
| | | | | | | lines extending beyond 72 characters (fixes bug #242232). (Portage version: 2.2_rc12/cvs/Linux 2.6.26-SENTINEL-3 i686) (Unsigned Manifest commit)
* Added -ffixed-line-length-132 to FFLAGS to avoid gcc-4.1.2 errors due to ↵Markus Dittrich2008-10-163-7/+12
| | | | | | lines extending beyond 72 characters (fixes bug #242232). (Portage version: 2.2_rc12/cvs/Linux 2.6.26-SENTINEL-3 i686)
* Latest version, closing bug #241474 thanks to Alexey ShvetsovJeffrey Gardner2008-10-121-1/+3
| | | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.26-gentoo-r1 x86_64) (Unsigned Manifest commit)
* Latest version, closing bug #241474 thanks to Alexey ShvetsovJeffrey Gardner2008-10-122-1/+217
| | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.26-gentoo-r1 x86_64)
* Made slight change to rungms script to allow parallel runs via environmental ↵Markus Dittrich2008-10-121-12/+2
| | | | | | | variables (see bug #241394). (Portage version: 2.2_rc11/cvs/Linux 2.6.26-SENTINEL-2 i686) (Unsigned Manifest commit)
* Made slight change to rungms script to allow parallel runs via environmental ↵Markus Dittrich2008-10-122-15/+49
| | | | | | variables (see bug #241394). (Portage version: 2.2_rc11/cvs/Linux 2.6.26-SENTINEL-2 i686)
* Version bump to pull in updated patch fixing bad install location for docs ↵Markus Dittrich2008-10-111-3/+4
| | | | | | | (see bug #241316). Added patch for ignored LDFLAGS. (Portage version: 2.2_rc11/cvs/Linux 2.6.26-SENTINEL-2 i686) (Unsigned Manifest commit)
* Version bump to pull in updated patch fixing bad install location for docs ↵Markus Dittrich2008-10-114-16/+54
| | | | | | (see bug #241316). Added patch for ignored LDFLAGS. (Portage version: 2.2_rc11/cvs/Linux 2.6.26-SENTINEL-2 i686)
* Added numpy dependency to stable ebuild as well (see bug #241178).Markus Dittrich2008-10-111-2/+2
| | | | | (Portage version: 2.2_rc11/cvs/Linux 2.6.26-SENTINEL-2 i686) (Unsigned Manifest commit)
* Added numpy dependency to stable ebuild as well (see bug #241178).Markus Dittrich2008-10-112-3/+7
| | | | (Portage version: 2.2_rc11/cvs/Linux 2.6.26-SENTINEL-2 i686)
* Added missing numpy dependency and fixed LDFLAGS issue (see bug #241178).Markus Dittrich2008-10-111-2/+3
| | | | | (Portage version: 2.2_rc11/cvs/Linux 2.6.26-SENTINEL-2 i686) (Unsigned Manifest commit)
* Added missing numpy dependency and fixed LDFLAGS issue (see bug #241178).Markus Dittrich2008-10-113-3/+21
| | | | (Portage version: 2.2_rc11/cvs/Linux 2.6.26-SENTINEL-2 i686)
* Fix build dependencies.Diego Elio Pettenò2008-10-101-5/+5
| | | | | (Portage version: 2.2_rc12/cvs/Linux 2.6.26-gentoo-r1 x86_64) (Signed Manifest commit)