| Commit message (Expand) | Author | Age | Files | Lines |
* | version bump | Christoph Junghans | 2013-01-19 | 3 | -10/+245 |
* | fix deps | Christoph Junghans | 2013-01-18 | 3 | -13/+15 |
* | sci-chemistry/aria: Help to find tarball | Justin Lecher | 2013-01-17 | 3 | -9/+12 |
* | sci-chemistry/ccpn: Todays python patches; fix for generic tcl/tk; drop unuse... | Justin Lecher | 2013-01-16 | 5 | -13/+193 |
* | sci-chemistry/aria: Version bump | Justin Lecher | 2013-01-11 | 4 | -13/+108 |
* | sci-chemistry/vmd: Use cuda.eclass and slo-operator for tcl | Justin Lecher | 2013-01-11 | 5 | -18/+279 |
* | sci-chemistry/namd: Link against versionless tcl/tk libs | Justin Lecher | 2013-01-11 | 4 | -10/+14 |
* | sci-chemistry/ccpn: Todays python patches | Justin Lecher | 2013-01-10 | 8 | -758/+32 |
* | sci-chemistry/ccp4-apps: Add fix for tcl-8.6 | Justin Lecher | 2013-01-10 | 5 | -9/+540 |
* | fixed build with mkl-11* | Christoph Junghans | 2012-12-29 | 3 | -18/+23 |
* | use new mercurial.eclass defaults | Christoph Junghans | 2012-12-26 | 8 | -32/+34 |
* | sync with sci overlay | Christoph Junghans | 2012-12-26 | 4 | -20/+44 |
* | sci-chemistry/openbabel-python: Add proposed enhancements by mgorny, #448118 | Justin Lecher | 2012-12-23 | 4 | -27/+21 |
* | version bump | Christoph Junghans | 2012-12-22 | 4 | -39/+33 |
* | sci-chemistry/rasmol: Drop old version; fixes 438428 | Justin Lecher | 2012-12-20 | 4 | -86/+11 |
* | x86 stable, see bug 438498 | Andreas Schuerch | 2012-12-20 | 3 | -9/+12 |
* | sci-chemistry/scala: Drop old | Justin Lecher | 2012-12-17 | 4 | -47/+22 |
* | Stable for ppc, wrt bug #446742 | Agostino Sarubbo | 2012-12-16 | 3 | -5/+8 |
* | Stable for x86, wrt bug #446742 | Agostino Sarubbo | 2012-12-14 | 3 | -5/+8 |
* | Stable for amd64, wrt bug #446742 | Agostino Sarubbo | 2012-12-14 | 3 | -17/+8 |
* | Fix LICENSE, Artistic License, Version 2.0 according to HOMEPAGE. | Ulrich Müller | 2012-12-14 | 3 | -9/+21 |
* | Fix LICENSE, MIT (Expat) according to License file. | Ulrich Müller | 2012-12-14 | 7 | -20/+35 |
* | sci-chemistry/mpqc: Run the intermediate testsuite | Justin Lecher | 2012-12-13 | 4 | -7/+21 |
* | sci-chemistry/ccp4i: Add missing dep on sci-libs/ccp4-libs, #405867 | Justin Lecher | 2012-12-13 | 4 | -20/+25 |
* | sci-chemistry/molsketch: Add quoting for prefix support | Justin Lecher | 2012-12-13 | 4 | -20/+24 |
* | sci-chemistry/ball: Fix for gcc-4.7, backported from upstream and stolen from... | Justin Lecher | 2012-12-13 | 6 | -22/+543 |
* | CMAKE_BUILD_DIR -> BUILD_DIR | Christoph Junghans | 2012-12-08 | 4 | -28/+32 |
* | sci-chemistry/reduce: Version BUmp | Justin Lecher | 2012-12-07 | 4 | -12/+81 |
* | version bump | Christoph Junghans | 2012-12-07 | 3 | -12/+18 |
* | sci-chemistry/avogadro: Version Bump prepared by Reinis Danne, #439436; fixes... | Justin Lecher | 2012-12-06 | 5 | -26/+105 |
* | sci-chemistry/openbabel-perl: Version Bump prepared by Reinis Danne, #439434 | Justin Lecher | 2012-12-06 | 5 | -15/+240 |
* | sci-chemistry/openbabel-python: Version Bump prepared by Reinis Danne, #439434 | Justin Lecher | 2012-12-06 | 5 | -17/+361 |
* | sci-chemistry/openbabel: Version Bump prepared by Reinis Danne, #439434 | Justin Lecher | 2012-12-06 | 4 | -16/+132 |
* | version bump | Christoph Junghans | 2012-11-30 | 4 | -12/+274 |
* | sci-chemistry/vmd: Drop dep on old tk | Justin Lecher | 2012-11-29 | 4 | -21/+15 |
* | sci-chemistry/namd: Drop old | Justin Lecher | 2012-11-29 | 5 | -263/+51 |
* | sci-chemistry/gabedit: Version Bump, #444155 | Justin Lecher | 2012-11-29 | 3 | -18/+93 |
* | sci-chemistry/cns: Drop default value of FCFLAGS as it is in the profile thes... | Justin Lecher | 2012-11-27 | 4 | -12/+15 |
* | sci-chemistry/ccpn: Todays python patches, drop USE=extendnmr | Justin Lecher | 2012-11-25 | 3 | -6/+186 |
* | Stable for x86, wrt bug #436886 | Agostino Sarubbo | 2012-11-21 | 3 | -15/+8 |
* | sci-chemistry/ccpn: Todays python patch | Justin Lecher | 2012-11-19 | 3 | -6/+193 |
* | sci-chemistry/rasmol: Add missing dep | Justin Lecher | 2012-11-19 | 3 | -18/+12 |
* | updated metadata.xml | Christoph Junghans | 2012-11-17 | 3 | -10/+16 |
* | fix build on x86 | Christoph Junghans | 2012-11-15 | 3 | -8/+15 |
* | sci-chemistry/vmd: Fix detection of netcdf; #406737, thanks Reinis Danne prep... | Justin Lecher | 2012-11-14 | 3 | -15/+243 |
* | sci-chemistry/ccpn: Todays Python Patches | Justin Lecher | 2012-11-12 | 3 | -6/+192 |
* | stable ppc, bug #438498 | Anthony G. Basile | 2012-11-11 | 3 | -5/+28 |
* | sci-chemistry/autodock_vina: Fix for boost >1.50, #425458 | Justin Lecher | 2012-11-07 | 4 | -16/+103 |
* | sci-chemistry/pymol-plugins-psico: Correct for moving of mmtk from sci-chemis... | Justin Lecher | 2012-11-06 | 4 | -12/+15 |
* | Move sci-chemistry/mmtk to sci-libs/mmtk due to duplication, #441648 | Justin Lecher | 2012-11-04 | 4 | -88/+0 |