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path: root/sci-chemistry/nwchem
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* sci-chemistry/nwchem version bumped to 6.6 with minor ebuild improvements; In...Honza Macháček2016-03-303-0/+305
* sci-chemistry/nwchem: Fix build with blas and lapackAlexey Shvetsov2016-03-231-2/+2
* Fix invalid metadata.xml syntaxJustin Lecher2016-03-061-12/+0
* metadata.xml: Set typeJustin Lecher2016-01-251-2/+2
* metadata.xml: convert hard -> projJustin Lecher2016-01-251-1/+4
* Drop ChangeLogs in favour of commit messagesJustin Lecher2016-01-071-127/+0
* Convert all $Header$ to $Id$ tags as it has be done in gentoo.gitJustin Lecher2015-08-173-3/+3
* Revert "Gentoo does https by default now"Justin Lecher2015-06-211-1/+1
* Gentoo does https by default nowJustin Lecher2015-06-211-1/+1
* Drop old python implementationsJustin Lecher2015-04-082-2/+2
* In sci-chemistry/nwchem-6.5_p26243-r7, 2 more upstream patches added (Hnd_rys...Honza Macháček2015-03-023-2/+12
* In sci-chemistry/nwchem-6.5_p26243-r6 two new upstream patches added (Dmapp_i...Honza Macháček2015-02-164-2/+27
* Added -lstdc++ to CUDA libraries in sci-chemistry/nwchem, now CUDA support (u...Honza Macháček2015-01-152-1/+8
* 2 new upstream patches of sci-chemistry/nwchem-6.5_p26243 added, USE_NOIO uns...Honza Macháček2015-01-053-5/+15
* Remove mpi USE flag from sci-chemistry/nwchem-6.5_p26243-r3 since MPI is mand...Honza Macháček2014-12-172-28/+37
* One more correction of 64 vs 32 bit integers handling in sci-chemistry/nwchem...Honza Macháček2014-12-092-33/+60
* Handling of 32-bit versus 64-bit integers in sci-chemistry/nwchem-6.5_p26243-...Honza Macháček2014-11-122-14/+30
* sci-chemistry/nwchem bumped to 6.5_p26243. IUSE options expanded, including t...Honza Macháček2014-11-115-1/+321
* clean upChristoph Junghans2014-09-162-2/+5
* Changed the versioning of sci-chemistry/nwchem to use the package patchlevel ...Honza Macháček2014-08-075-158/+70
* Sanitize ebuild headerJustin Lecher2014-01-302-2/+2
* In sci-chemistry/nwchem-6.3-r2, arranged for the TeX fonts creation in the sa...Honza Macháček2013-10-192-1/+4
* sci-chemistry/nwchem updated to 6.3 revision 2. The source directory name sho...Honza Macháček2013-10-193-0/+166
* sci-chemistry/nwchem updated to 6.3-r1, python makefile patch cosmetically im...Honza Macháček2013-07-236-93/+34
* sci-chemistry/nwchem: Drop old; drop virtual/fortran as the eclass depends on itJustin Lecher2013-06-164-131/+10
* sci-chemistry/nwchem: Fix for correct usage of new python eclassesJustin Lecher2013-06-042-0/+5
* sci-chemistry/freeon improved, the ebuild of the latest snapshot added. sci-c...Honza Macháček2013-05-304-0/+235
* Improving mpi linking. It will now work with openmpi as well.François Bissey2013-03-142-1/+5
* sci-chemistry/nwchem: Move to EAPI=5 and clean ebuild syntax styleJustin Lecher2013-03-033-59/+52
* [sci-chemistry/nwchem] Initial import from bug #393139. Mpi still doesnt workAlexey Shvetsov2012-12-028-0/+223