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path: root/sci-chemistry/gromacs
Commit message (Collapse)AuthorAgeFilesLines
* live ebuild updateChristoph Junghans2012-10-043-12/+13
| | | | (Portage version: 2.2.0_alpha135/git/Linux i686, unsigned Manifest commit)
* hybrid stuff got mergedChristoph Junghans2012-10-033-10/+7
| | | | (Portage version: 2.2.0_alpha134/git/Linux i686, unsigned Manifest commit)
* use ninja if availableChristoph Junghans2012-08-082-5/+6
| | | | (Portage version: 2.2.0_alpha120/git/Linux i686, unsigned Manifest commit)
* added ~x86-macosChristoph Junghans2012-07-245-8/+16
| | | | (Portage version: 2.2.0_alpha120/git/Linux i686, unsigned Manifest commit)
* [sci-chemistry/gromacs] Add new acceleration use flags for gromacsAlexey Shvetsov2012-06-194-15/+32
| | | | (Portage version: 2.2.0_alpha110/git/Linux x86_64, unsigned Manifest commit)
* add support for new hybrid kernelsChristoph Junghans2012-06-104-4/+27
| | | | (Portage version: 2.2.0_alpha110/git/Linux i686, unsigned Manifest commit)
* [sci-chemistry/gromacs] add more mirrorsChristoph Junghans2012-04-272-1/+7
| | | | (Portage version: 2.2.0_alpha101/git/Linux i686, unsigned Manifest commit)
* [sci-chemistry/gromacs] Also add http mirror git uriAlexey Shvetsov2012-04-194-3/+7
| | | | (Portage version: 2.2.0_alpha100/git/Linux x86_64, unsigned Manifest commit)
* removed obsolete call to env-updateChristoph Junghans2012-03-033-4/+6
| | | | (Portage version: 2.2.0_alpha89/git/Linux i686, unsigned Manifest commit)
* reworked fortran and openmp supportChristoph Junghans2012-03-032-14/+25
| | | | (Portage version: 2.2.0_alpha89/git/Linux i686, unsigned Manifest commit)
* sci-chemistry/gromacs: clean upChristoph Junghans2012-02-122-45/+10
| | | | (Portage version: 2.2.0_alpha86/git/Linux i686, unsigned Manifest commit)
* sci-chemistry/gromacs: fixed threads and mpiChristoph Junghans2012-02-112-6/+8
| | | | (Portage version: 2.2.0_alpha85/git/Linux i686, unsigned Manifest commit)
* handle new vmd detectionChristoph Junghans2012-02-052-4/+4
| | | | (Portage version: 2.2.0_alpha85/git/Linux i686, unsigned Manifest commit)
* added openmp supportChristoph Junghans2012-02-043-5/+9
| | | | (Portage version: 2.2.0_alpha84/git/Linux i686, unsigned Manifest commit)
* Convert to thin manifests (as suggested by alexxy and jlec)Andreas K. Huettel (dilfridge)2012-01-141-19/+0
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* [sci-chemistry/gromacs] added 4.6 live versionChristoph Junghans2011-09-283-8/+253
| | | | (Portage version: 2.1.10.11/git/Linux i686, signed Manifest commit with key C2000586)
* [sci-chemistry/gromacs] Migrate to the bash-completion-r1 eclassChristoph Junghans2011-09-104-38/+36
| | | | (Portage version: 2.1.10.11/git/Linux i686, signed Manifest commit with key C2000586)
* [sci-chemistry/gromacs] sync with treeChristoph Junghans2011-07-184-5/+31
| | | | (Portage version: 2.1.10.3/git/Linux i686, signed Manifest commit with key C2000586)
* Merge branch 'master' of git+ssh://git.overlays.gentoo.org/proj/sciJustin Lecher2011-06-252-11/+5
|\ | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | * 'master' of git+ssh://git.overlays.gentoo.org/proj/sci: [sys-cluster/nullmpi] migrate to git-2 [sci-chemistry/gromacs] migrate to git-2 [sci-physics/espresso] migrate to git-2 [app-doc/gromacs-manual] migrate to git-2 Conflicts: app-doc/gromacs-manual/ChangeLog app-doc/gromacs-manual/Manifest app-doc/gromacs-manual/gromacs-manual-9999.ebuild sci-chemistry/gromacs/ChangeLog sci-chemistry/gromacs/Manifest sci-physics/espresso/ChangeLog sci-physics/espresso/Manifest sys-cluster/nullmpi/ChangeLog sys-cluster/nullmpi/Manifest sys-cluster/nullmpi/nullmpi-9999.ebuild Signed-off-by: Justin Lecher <jlec@gentoo.org>
| * [sci-chemistry/gromacs] migrate to git-2Christoph Junghans2011-06-254-12/+16
| | | | | | | | (Portage version: 2.1.9.42/git/Linux i686, signed Manifest commit with key C2000586)
* | migrate from 'git' to 'git-2'Justin Lecher2011-06-255-17/+17
|/ | | | (Portage version: 2.2.0_alpha41/git/Linux x86_64, signed Manifest commit with key 70EB7916)
* [sci-chemistry/gromacs] only USE=fkernels needs fortranChristoph Junghans2011-06-214-6/+24
| | | | (Portage version: 2.1.9.42/git/Linux i686, signed Manifest commit with key C2000586)
* Added fortran-2.eclass supportJustin Lecher2011-06-214-12/+12
| | | | (Portage version: 2.2.0_alpha41/git/Linux x86_64, signed Manifest commit with key 70EB7916)
* [sci-chemistry/gromacs] switch to cmakeChristoph Junghans2011-06-194-75/+61
| | | | (Portage version: 2.1.9.42/git/Linux i686, signed Manifest commit with key C2000586)
* [sci-chemistry/gromacs] sync with treeChristoph Junghans2011-05-013-50/+36
| | | | (Portage version: 2.1.9.42/git/Linux i686, signed Manifest commit with key C2000586)
* [sci-chemistry/gromacs] remove 4.0.* (EOM)Christoph Junghans2011-04-104-317/+13
| | | | (Portage version: 2.1.9.42/git/Linux i686, signed Manifest commit with key C2000586)
* [sci-chemistry/gromacs] Update ebuild for using pkg-config and blasAlexey Shvetsov2011-03-182-12/+18
| | | | (Portage version: 2.2.0_alpha27/git/Linux x86_64, signed Manifest commit with key F82F92E6)
* [sci-chemistry/gromacs] added fixes from 4.5.3-r4Christoph Junghans2011-03-084-17/+28
| | | | (Portage version: 2.1.9.25/git/Linux i686, signed Manifest commit with key C2000586)
* Correct Slots for gtk 3 introduction to treeJustin Lecher2011-03-075-39/+38
| | | | (Portage version: 2.2.0_alpha26/git/Linux x86_64, signed Manifest commit with key 70EB7916)
* Add epatch_user back for gromacs live ebuildsAlexey Shvetsov2011-03-013-13/+25
| | | | (Portage version: 2.2.0_alpha25/git/Linux x86_64, signed Manifest commit with key F82F92E6)
* [sci-chemistry/gromacs] 4.5.3-r3 InCVSChristoph Junghans2011-02-193-270/+11
| | | | (Portage version: 2.1.9.25/git/Linux i686, signed Manifest commit with key C2000586)
* [sci-chemistry/gromacs] version bumpChristoph Junghans2011-02-173-11/+25
| | | | (Portage version: 2.1.9.25/git/Linux i686, signed Manifest commit with key C2000586)
* [sci-chemistry/gromacs] fixes bug #339837Christoph Junghans2011-02-145-27/+55
| | | | (Portage version: 2.1.9.25/git/Linux i686, signed Manifest commit with key C2000586)
* [sci-chemistry/gromacs] qa fixesChristoph Junghans2011-02-134-21/+276
| | | | (Portage version: 2.1.9.25/git/Linux i686, signed Manifest commit with key C2000586)
* [sci-chemistry/gromacs] added back gsl/xml useflagChristoph Junghans2011-01-222-14/+12
| | | | (Portage version: 2.1.9.25/git/Linux i686, signed Manifest commit with key A9ECD7F9)
* [sci-chemistry/gromacs] fixed some typosChristoph Junghans2011-01-212-7/+8
| | | | (Portage version: 2.1.9.25/git/Linux i686, signed Manifest commit with key A9ECD7F9)
* [sci-chemistry/gromacs] add back live manualChristoph Junghans2011-01-213-16/+18
| | | | (Portage version: 2.1.9.25/git/Linux i686, signed Manifest commit with key A9ECD7F9)
* [sci-chemistry/gromacs] qa fixesChristoph Junghans2011-01-183-8/+14
| | | | (Portage version: 2.1.9.25/git/Linux i686, signed Manifest commit with key A9ECD7F9)
* [sci-chemistry/gromacs] suffix fixChristoph Junghans2011-01-093-12/+21
| | | | (Portage version: 2.1.9.25/git/Linux i686, signed Manifest commit with key A9ECD7F9)
* [sci-chemistry/gromacs] 9999 version uses cmake-utils eclassChristoph Junghans2011-01-094-123/+69
| | | | (Portage version: 2.1.9.25/git/Linux i686, signed Manifest commit with key A9ECD7F9)
* [sci-chemistry/gromacs] 4.5.9999 now uses autotools-utils eclassChristoph Junghans2011-01-092-97/+72
| | | | (Portage version: 2.1.9.25/git/Linux i686, signed Manifest commit with key A9ECD7F9)
* Removal of fortran.eclass, #348851Justin Lecher2010-12-165-40/+27
| | | | (Portage version: 2.2.0_alpha8/git/Linux x86_64, signed Manifest commit with key 70EB7916)
* Update manifestAlexey Shvetsov2010-11-251-19/+1
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* [sci-chemistry/gromacs] Moved to treeAlexey Shvetsov2010-11-256-842/+6
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* [sci-chemistry/gromacs] version bumpChristoph Junghans2010-11-233-4/+280
| | | | | (Portage version: 2.1.8.3/git/Linux i686) (Signed Manifest commit)
* [sci-chemistry/gromacs] version bumpChristoph Junghans2010-10-303-4/+280
| | | | | (Portage version: 2.1.8.3/git/Linux i686) (Signed Manifest commit)
* [sci-chemistry/gromacs] added natural vmd support (bug #340651#c8)Christoph Junghans2010-10-255-12/+19
| | | | | (Portage version: 2.1.8.3/git/Linux i686) (Signed Manifest commit)
* [sci-chemistry/gromacs] multilib fixChristoph Junghans2010-10-222-5/+5
| | | | | (Portage version: 2.1.8.3/git/Linux i686) (Signed Manifest commit)
* [sci-chemistry/gromacs] added vmd use flagChristoph Junghans2010-10-214-7/+16
| | | | | (Portage version: 2.1.8.3/git/Linux i686) (Signed Manifest commit)
* [sci-chemistry/gromacs] renamed manual distfileChristoph Junghans2010-10-174-11/+15
| | | | | (Portage version: 2.1.8.3/git/Linux i686) (Signed Manifest commit)