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path: root/sci-chemistry
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* sci-chemistry/relax: Use HTTPSMichał Górny2020-01-161-1/+1
* sci-chemistry/pymol: Use HTTPSMichał Górny2020-01-162-4/+4
* sci-chemistry/pdb2pqr: Use HTTPSMichał Górny2020-01-161-1/+1
* sci-chemistry/nmrglue: Use HTTPSMichał Górny2020-01-161-1/+1
* sci-chemistry/vmd: Permit numpy-python2Michał Górny2020-01-164-8/+20
* sci-chemistry/relax: Permit numpy-python2Michał Górny2020-01-161-2/+5
* sci-chemistry/pymol: Permit numpy-python2Michał Górny2020-01-162-2/+8
* sci-chemistry/pdb2pqr: Permit numpy-python2Michał Górny2020-01-161-2/+5
* sci-chemistry/ParmEd: Remove Python 2Michał Górny2020-01-162-2/+2
* sci-chemistry/nmrglue: Remove Python 2Michał Górny2020-01-161-1/+1
* sci-chemistry/nmrdepaker: Permit numpy-python2Michał Górny2020-01-161-2/+5
* sci-chemistry/GromacsWrapper: Remove Python 2Michał Górny2020-01-161-1/+1
* sci-chemistry/chemex: Permit numpy-python2Michał Górny2020-01-161-2/+5
* sci-chemistry/votca-ctp: live ebuild removal due missing depsChristoph Junghans2020-01-121-71/+0
* sci-chemistry/votca-xtp: version bumpChristoph Junghans2020-01-123-34/+50
* sci-chemistry/votca-csgapps: version bumpChristoph Junghans2020-01-123-3/+37
* sci-chemistry/votca-csg: version bumpChristoph Junghans2020-01-123-11/+98
* sci-chemistry/votca-csg: fix depsChristoph Junghans2020-01-122-4/+4
* sci-chemistry/gromacs: amd64 stable wrt bug #703796Agostino Sarubbo2020-01-091-2/+2
* */*: Clean PYTHON_COMPAT of obsolete implsMichał Górny2020-01-0513-23/+23
* sci-chemistry/gromacs: Fix bashcomp installAlexey Shvetsov2020-01-032-2/+2
* sci-chemistry/gromacs: Version bumpAlexey Shvetsov2020-01-024-15/+401
* sci-chemistry/gromacs: Drop old versionsAlexey Shvetsov2020-01-022-274/+0
* sci-chemistry/gromacs: arm stable wrt bug #703794Agostino Sarubbo2020-01-011-2/+2
* sci-chemistry/xyza2pipe: use ASCII whitespaceSergei Trofimovich2019-12-301-2/+2
* sci-chemistry/gromacs: x86 stable wrt bug #703796Agostino Sarubbo2019-12-301-1/+1
* sci-chemistry/gromacs: x86 stable wrt bug #703794Agostino Sarubbo2019-12-301-1/+1
* sci-chemistry/mdtraj: Drop python2_7Andreas Sturmlechner2019-12-291-2/+1
* sci-chemistry/gmxapi: Drop python2_7Andreas Sturmlechner2019-12-291-1/+1
* sci-chemistry/gromacs: amd64 stable wrt bug #703794Agostino Sarubbo2019-12-271-1/+1
* sci-chemistry/MDAnalysis: Remove Py2David Seifert2019-12-261-1/+1
* sci-chemistry/gromacs: Drop redundant versionsAlexey Shvetsov2019-12-253-632/+0
* sci-chemistry/gromacs: 2020_rc1Alexey Shvetsov2019-12-243-25/+23
* sci-chemistry/gromacs: Version bumpAlexey Shvetsov2019-12-232-0/+316
* sci-chemistry/vmd: Fix /tmp PATH, open .pdb files as pymol doesPacho Ramos2019-12-152-0/+288
* sci-chemistry/chemical-mime-data: Drop oldPacho Ramos2019-12-151-60/+0
* sci-chemistry/chemical-mime-data: Update HOMEPAGEPacho Ramos2019-12-151-1/+1
* sci-chemistry/cluster: drop old EAPIAaron Bauman2019-12-121-29/+0
* */*: [QA] Remove redundant `|| die` guardsDavid Seifert2019-12-113-6/+5
* */*: [QA] Fix trivial cases of MissingTestRestrictMichał Górny2019-12-119-6/+15
* profiles/package.mask: drop last-rited pkgsAaron Bauman2019-12-086-145/+0
* sci-chemistry/molden: remove unused patchesMichael Mair-Keimberger2019-12-062-50/+0
* sci-chemistry/apbs: python_export_best → python_setupMichał Górny2019-11-291-1/+1
* sci-chemistry/povscript+: drop old EAPIAaron Bauman2019-11-232-55/+0
* sci-chemistry/molden: drop old EAPIAaron Bauman2019-11-233-154/+0
* sci-chemistry/ksdssp: drop oldAaron Bauman2019-11-231-44/+0
* sci-chemistry/votca-xtp: version bumpChristoph Junghans2019-11-212-0/+75
* sci-chemistry/votca-ctp: Version bumpChristoph Junghans2019-11-212-0/+73
* sci-chemistry/votca-csgapps: version bumpChristoph Junghans2019-11-212-0/+34
* sci-chemistry/votca-csg: version bumpChristoph Junghans2019-11-212-0/+103