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Commit message (Expand)AuthorAgeFilesLines
* sci-chemistry/coot: Host testcases on gentoo infraJustin Lecher2017-12-102-2/+2
* sci-chemistry/coot: Partially update Manifest hashes.Ulrich Müller2017-12-101-1/+1
* sci-chemistry/molscript: Update Manifest hashes.Ulrich Müller2017-12-101-1/+1
* sci-chemistry/msms-bin: Update Manifest hashes.Ulrich Müller2017-12-101-2/+2
* sci-chemistry/aqua: Update Manifest hashes.Ulrich Müller2017-12-101-2/+2
* sci-chemistry/ccpn: Update Manifest hashes.Ulrich Müller2017-12-101-6/+6
* sci-chemistry/*: Update Manifest hashesMichał Górny2017-12-1089-147/+147
* sci-chemistry/vmd: Version bumpAlexey Shvetsov2017-12-082-2/+254
* sci-chemistry/suitename: [QA] Fix DESCRIPTION.toolongDavid Seifert2017-12-021-1/+1
* sci-chemistry/shelx: [QA] Fix DESCRIPTION.toolongDavid Seifert2017-12-021-1/+1
* sci-chemistry/propka: [QA] Fix DESCRIPTION.toolongDavid Seifert2017-12-021-1/+1
* sci-chemistry/prekin: [QA] Fix DESCRIPTION.toolongDavid Seifert2017-12-021-1/+1
* sci-chemistry/pdbcns: [QA] Fix DESCRIPTION.toolongDavid Seifert2017-12-021-1/+1
* sci-chemistry/pdb2pqr: [QA] Fix DESCRIPTION.toolongDavid Seifert2017-12-021-1/+1
* sci-chemistry/pdb-tools: [QA] Fix DESCRIPTION.toolongDavid Seifert2017-12-022-2/+2
* sci-chemistry/msms-bin: [QA] Fix DESCRIPTION.toolongDavid Seifert2017-12-021-1/+1
* sci-chemistry/molscript: [QA] Fix DESCRIPTION.toolongDavid Seifert2017-12-021-1/+1
* sci-chemistry/gsim: [QA] Fix DESCRIPTION.toolongDavid Seifert2017-12-021-1/+1
* sci-chemistry/gromacs: Add opencl support and 2018_beta1Alexey Shvetsov2017-12-015-0/+622
* sci-chemistry/relax: [QA] Consistent whitespace in metadata.xmlDavid Seifert2017-11-251-24/+24
* sci-chemistry/prodecomp: [QA] Consistent whitespace in metadata.xmlDavid Seifert2017-11-251-14/+14
* sci-chemistry/openbabel: [QA] Consistent whitespace in metadata.xmlDavid Seifert2017-11-251-13/+13
* sci-chemistry/molsketch: [QA] Consistent whitespace in metadata.xmlDavid Seifert2017-11-251-12/+12
* sci-chemistry/gromacs: [QA] Consistent whitespace in metadata.xmlDavid Seifert2017-11-251-24/+24
* sci-chemistry/gperiodic: [QA] Consistent whitespace in metadata.xmlDavid Seifert2017-11-251-3/+3
* sci-chemistry/easychem: [QA] Consistent whitespace in metadata.xmlDavid Seifert2017-11-251-14/+14
* sci-chemistry/bodr: [QA] Consistent whitespace in metadata.xmlDavid Seifert2017-11-251-14/+14
* sci-chemistry/avogadro: [QA] Consistent whitespace in metadata.xmlDavid Seifert2017-11-251-16/+16
* sci-chemistry/autodock_vina: [QA] Consistent whitespace in metadata.xmlDavid Seifert2017-11-251-25/+23
* profiles: Remove last-rited packagesAndreas Sturmlechner2017-10-303-40/+0
* sci-chemistry/molmol: Move patches to dist tarballDavid Seifert2017-10-3013-2540/+36
* sci-chemistry/molmol: stable 2k_p2-r5 for ppc, bug #630350Sergei Trofimovich2017-10-291-2/+2
* sci-chemistry/reduce: remove unused patch.Michael Mair-Keimberger2017-10-271-22/+0
* sci-chemistry/molsketch: remove unused patch.Michael Mair-Keimberger2017-10-271-16/+0
* sci-chemistry/jmol: remove unused patches.Michael Mair-Keimberger2017-10-272-362/+0
* sci-chemistry/tm-align: [QA] Add cmake-utils_src_prepareDavid Seifert2017-10-152-2/+6
* sci-chemistry/openbabel-perl: [QA] Add cmake-utils_src_prepareDavid Seifert2017-10-152-2/+2
* sci-chemistry/molequeue: [QA] Add cmake-utils_src_prepareDavid Seifert2017-10-151-1/+2
* sci-chemistry/massxpert: [QA] Add cmake-utils_src_prepareDavid Seifert2017-10-151-2/+3
* sci-chemistry/openbabel-python: avoid installing python modules to /lib/Michael Palimaka2017-10-051-1/+1
* sci-chemistry/openbabel-perl: stabilise 2.4.11 for x86Michael Palimaka2017-10-051-1/+1
* sci-chemistry/openbabel-python: stabilise 2.4.1 for x86Michael Palimaka2017-10-051-1/+1
* sci-chemistry/openbabel: stabilise 2.4.1 for x86Michael Palimaka2017-10-051-1/+1
* sci-chemistry/pymol-plugins-dynamics: Version BumpJustin Lecher2017-10-022-0/+38
* sci-chemistry/molequeue: remove 0.7.1Michael Palimaka2017-09-242-58/+0
* sci-chemistry/avogadro2: remove oldMichael Palimaka2017-09-245-264/+0
* sci-chemistry/dssp: Fix boost TR1 header includeDavid Seifert2017-09-162-13/+97
* sci-chemistry/gromacs: version bumpChristoph Junghans2017-09-152-0/+278
* sci-chemistry/rasmol: dropped ppc keywordsMatt Turner2017-09-121-2/+2
* sci-chemistry/surf: dropped ppc keywordsMatt Turner2017-09-121-2/+2