Allow gmx tune_pme to skip the check for command-line health
[alexxy/gromacs.git] / share /
2014-09-29 Roland SchulzMerge release-4-6 into release-5-0
2014-09-18 Mark AbrahamMerge branch release-4-6 into release-5-0
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
2014-08-23 Mark AbrahamUnify documentation for webpage build
2014-08-10 Roland SchulzMerge release-4-6 into release-5-0
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
2014-06-27 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.
2014-06-14 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.
2014-06-06 Mark AbrahamMerge release-4-6 into release-5-0
2014-06-05 Mark AbrahamNew quotes
2014-06-04 Rossen ApostolovUpdated C-/N-terminal partial charges in Amber03.ff.
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-4-6 into release-5-0
2014-05-22 Berk HessAvoid energy drift with verlet-buffer-tolerance
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
2014-04-10 Mark AbrahamMerge branch 'release-4-6' into release-5-0
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..
2014-01-29 Berk HessAutomated Verlet rlist for NVE simulations
2014-01-28 Mark AbrahamMerge branch 'release-4-6'
2014-01-28 Teemu MurtolaShell completion export from the wrapper binary
2014-01-21 Justin LemkulAdded ASPP and GLUP to residuetypes.dat.
2014-01-20 Mark AbrahamRename 'gmx tpbconv' to 'gmx convert-tpr'
2014-01-20 Magnus LundborgAdd TNG writing and reading support
2014-01-14 Teemu MurtolaDon't install links.dat
2014-01-13 Teemu MurtolaFix installation of HTML manual
2014-01-09 Roland SchulzMerge release-4-6 into master
2014-01-05 Carsten KutznerRemoved a few typos in three German quotes.
2014-01-01 Roland SchulzMerge release-4-6 into master
2013-12-21 David van der SpoelMore Nobel quotes and others
2013-12-17 Erik LindahlAdded a bunch of quotes from the 2013 Nobel lectures
2013-12-05 Mark AbrahamFix administrivia
2013-12-03 Berk HessRemoved restriction of one reference pull group
2013-12-02 Berk HessMade cutoff-scheme=Verlet the default
2013-12-02 Berk HessRenamed verlet-buffer-drift to verlet-buffer-tolerance
2013-12-02 Mark AbrahamVersion bumps before release
2013-12-02 Roland SchulzMerge "Merge branch 'release-4-6'"
2013-12-02 Christian WennbergCalculating LJ-interactions using Particle mesh Ewald
2013-12-02 Mark AbrahamMerge branch 'release-4-6'
2013-12-02 Teemu MurtolaUniform behavior for 'make man' and 'make html'
2013-11-28 Teemu MurtolaGenerate gromacs.7 from the wrapper binary
2013-11-28 Teemu MurtolaUniform headers in HTML pages
2013-11-17 Teemu MurtolaReformat existing LGPL copyright notices.
2013-11-17 Teemu MurtolaRemove more obsolete content from share/html.
2013-11-16 Teemu MurtolaAdd listing of programs by topic to HTML output.
2013-11-15 Erik LindahlMerge "Merge branch release-4-6"
2013-11-15 Mark AbrahamMerge branch release-4-6
2013-11-13 Mark AbrahamFix minor things before release
2013-11-07 David van der Spoel12 new quotes
2013-10-30 Teemu MurtolaMarkup substitution through HelpWriterContext.
2013-10-30 Roland SchulzMerge release-4-6 into master
2013-10-28 Teemu MurtolaOverview Doxygen pages for analysis framework.
2013-10-28 Mark AbrahamCreate fileio module
2013-10-23 Mark AbrahamMerge branch release-4-6 into master
2013-10-15 Teemu MurtolaFix/improve installation directory logic.
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