Add initial support for python bindings
[alexxy/gromacs.git] / share /
2014-10-01 Mark AbrahamMerge release-5-0 into master
2014-09-29 Roland SchulzMerge release-4-6 into release-5-0
2014-09-22 Mark AbrahamMore quotes
2014-09-22 Teemu MurtolaMerge "Merge release-5-0 into master"
2014-09-22 Erik LindahlMore quotes
2014-09-21 Roland SchulzMerge release-5-0 into master
2014-09-20 Erik LindahlAdded a bunch of new and old quotes.
2014-09-18 Mark AbrahamMerge branch release-4-6 into release-5-0
2014-09-17 Roland SchulzMerge release-5-0 into master
2014-09-17 David van der SpoelMerge release-5-0 into master
2014-09-10 Roland SchulzMerge release-5-0 into master
2014-09-07 Teemu MurtolaUpdate template/README
2014-09-05 Roland SchulzMerge release-5-0 into master
2014-09-04 Teemu MurtolaMerge "Merge release-5-0 into master"
2014-09-03 Roland SchulzMerge release-5-0 into master
2014-09-03 Mark AbrahamMore hacking to get the template to detect and build
2014-09-01 Mark AbrahamFix and document issues with template.cpp
2014-09-01 Mark AbrahamMerge branch release-4-6 into release-5-0
2014-08-29 Mark AbrahamMerge branch release-4-6 into release-5-0
2014-08-25 Roland SchulzMerge release-5-0 into master
2014-08-23 Mark AbrahamUnify documentation for webpage build
2014-08-20 Teemu MurtolaMerge release-5-0 into master
2014-08-17 Roland SchulzRemove check that auto-generated files exist
2014-08-16 Roland SchulzMerge release-5-0 into master
2014-08-13 Teemu MurtolaUse native CMake mechanism for find_package(GROMACS)
2014-08-11 Mark AbrahamAdd depressing quote
2014-08-10 Roland SchulzMerge release-4-6 into release-5-0
2014-07-31 Roland SchulzMerge release-5-0 into master
2014-07-28 Roland SchulzMerge release-5-0 into master
2014-07-09 Teemu MurtolaMerge release-5-0 into master
2014-07-05 Teemu MurtolaMerge release-5-0 into master
2014-06-30 Teemu MurtolaMerge release-5-0 into master
2014-06-29 Mark AbrahamRefer to "mixed" precision in user-facing documentation
2014-06-29 Roland SchulzMerge release-4-6 into release-5-0
2014-06-29 Michael ShirtsAllow printing potential energies to dhdl.xvg file
2014-06-28 Mark AbrahamMerge branch 'release-4-6' into release-5-0
2014-06-28 ngogaDefault SD integrator is now sd1 by Nicu Goga
2014-06-28 Roland SchulzMerge release-5-0 into master
2014-06-27 Roland SchulzMerge release-4-6 into release-5-0
2014-06-27 Carsten KutznerRemove obsolete pull-geometry option 'position' from...
2014-06-26 Mark AbrahamMerge "Merge release-4-6 into release-5-0" into release-5-0
2014-06-26 Roland SchulzMerge release-4-6 into release-5-0
2014-06-25 Erik LindahlUpdated Amber GBSA parameters
2014-06-24 Erik LindahlFixed GROMOS assignment of PRO-NH terminus torsions
2014-06-23 Erik LindahlEnable terminus-specific atom translation
2014-06-23 Rossen ApostolovAdded tip5p to the list of watermodels in some FF.
2014-06-21 Erik LindahlMake sure masses are copied from termini databases
2014-06-20 Rossen ApostolovFixed typo in oplsaa ASPH charges.
2014-06-20 Rossen ApostolovRemoved unused parameters and cleanup of inputrec.
2014-06-19 Roland SchulzMerge release-5-0 into master
2014-06-18 Roland SchulzMerge release-5-0 into master
2014-06-15 Teemu MurtolaRemove unused figures from share/html/
2014-06-14 Rossen ApostolovAdded tip5pe water model to oplsa.
2014-06-12 Erik LindahlAdded dummy mass for charmm TYR aromatic vsites
2014-06-11 Rossen ApostolovMapped HIS1 to HSD in charmm27.
2014-06-07 David van der SpoelMerge "Merge release-5-0 into master"
2014-06-07 David van der SpoelMerge release-5-0 into master
2014-06-06 Mark AbrahamMerge release-4-6 into release-5-0
2014-06-05 Mark AbrahamNew quotes
2014-06-05 Mark AbrahamMerge "Merge release-5-0 into master"
2014-06-04 Rossen ApostolovUpdated C-/N-terminal partial charges in Amber03.ff.
2014-06-03 Roland SchulzMerge release-5-0 into master
2014-06-01 Szilárd PállAdd quote on the kT-kj/mol conversion factor
2014-06-01 Erik LindahlTwo quotes contributed by Vedran Miletic
2014-05-27 Roland SchulzMerge release-5-0 into master
2014-05-27 Roland SchulzMerge release-4-6 into release-5-0
2014-05-22 Berk HessAvoid energy drift with verlet-buffer-tolerance
2014-05-10 Roland SchulzMerge release-5-0 into master
2014-05-10 Roland SchulzMerge release-4-6 into release-5-0
2014-04-29 Mark AbrahamMerge branch release-4-6 into release-5-0
2014-04-16 Roland SchulzMerge release-5-0 into master
2014-04-15 Mark AbrahamBeer + table soccer = quote!
2014-04-10 Mark AbrahamMerge branch 'release-4-6' into release-5-0
2014-04-09 Justin LemkulFixed MG typo in residuetypes.dat
2014-03-31 Mark AbrahamRemove quote
2014-03-31 Teemu MurtolaRemove dependency on commandline/ from oenv.cpp
2014-03-23 Mark AbrahamMerge branch release-4-6
2014-03-18 Mark AbrahamRevert "Added new amber99sb-ildn-bsc0 force field."
2014-03-18 Mark AbrahamRemoved more stuff related to gmx.ff and gmx2.ff
2014-03-17 Mark AbrahamMerge branch release-4-6
2014-03-11 Rossen ApostolovRemoved .itp files from top level directory.
2014-03-06 Rossen ApostolovRemoved the deprecated gmx.ff and gmx2.ff.
2014-03-06 David van der SpoelSix new quotes from classic literature.
2014-03-03 Roland SchulzMerge release-4-6 into master
2014-02-26 Michael ShirtsUpdating and improving Andersen thermostat documentation
2014-02-23 Rossen ApostolovRemoved deprecated Encad FF.
2014-02-21 Roland SchulzMerge "Merge release-4-6 into master"
2014-02-21 Nina FischerAdded new amber99sb-ildn-bsc0 force field.
2014-02-21 Roland SchulzMerge release-4-6 into master
2014-02-20 Mark AbrahamRemove particle decomposition
2014-02-19 Berk HessImplemented nbnxn LJ switch functions
2014-02-16 Mark AbrahamRemove support for .g87 and .xyz I/O formats
2014-02-15 Teemu MurtolaFix some broken links in HTML pages
2014-02-11 Mark AbrahamSplit genbox into 'solvate' and 'insert-molecules'
2014-02-06 Teemu MurtolaFix build of share/template when installed
2014-02-06 Roland SchulzUse random seeds by default
2014-02-02 Roland SchulzMerge release-4-6 into master
2014-02-02 Teemu MurtolaSimplify Options::setDescription() usage
2014-01-30 Rossen ApostolovRemoved ions.itp from GMX/share/top directory.
2014-01-29 Justin LemkulClarified use of table-extension..
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