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added Verlet scheme and NxN non-bonded functionality
[alexxy/gromacs.git]
/
src
/
gmxlib
/
names.c
2012-10-02
Szilard Pall
added Verlet scheme and NxN non-bonded functionality
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2012-10-01
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-09-03
Szilard Pall
Merge branch 'release-4-5-patches' into release-4-6
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2012-07-13
Roland Schulz
Merge release-4.5-patches into HEAD
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2012-06-04
Michael Shirts
Merging in free energy, exp. ensemble, & andersen t...
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2012-06-01
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-05-07
Teemu Murtola
Merge branch 'gerrit/release-4-5-patches' into release-4-6
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2012-04-29
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-04-29
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-04-26
Berk Hess
Merge release-4-5-patches into release-4-6
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2012-04-25
Berk Hess
replaced PPPM by P3M-AD: a few lines in pme.c
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2012-04-03
Roland Schulz
Merge remote-tracking branch 'gerrit/release-4-5-patche...
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2012-03-28
Szilard Pall
Merge branch 'release-4-5-patches' into release-4-6
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2012-03-16
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-02-29
Szilard Pall
Merge branch 'release-4-5-patches' into release-4-6
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2012-02-23
Roland Schulz
Merge remote-tracking branch 'gerrit/release-4-5-patche...
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2012-02-08
Roland Schulz
Merge remote-tracking branch 'gerrit/release-4-5-patche...
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2012-02-03
Roland Schulz
Merge remote-tracking branch 'gerrit/release-4-5-patche...
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2012-01-19
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-01-13
Roland Schulz
Merge "Fixed MSVC compiling with plug-in support" into...
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2012-01-10
Christoph Junghans
Adds AdResS feature to gromacs
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2011-12-26
Roland Schulz
Merge remote-tracking branch 'gerrit/release-4-5-patche...
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2011-12-20
Roland Schulz
Merge release-4-5-patches into release-4-6
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2011-12-19
Carsten Kutzner
Enforced rotation
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2011-12-11
Roland Schulz
Merge release-4-5-patches into release-4-6
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2011-12-08
Roland Schulz
Merge "Added an option to easily compile contrib progra...
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2011-11-27
Roland Schulz
Merge "Fixes inconsistent spelling of Git cmake variabl...
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2011-11-27
Roland Schulz
Merge remote-tracking branch 'gerrit/release-4-5-patche...
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2011-11-27
Roland Schulz
Merge "Replace '_' in all mdp options to '-'" into...
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2011-10-20
Alexey Shvetsov
Replace '_' in all mdp options to '-'
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2011-01-30
David van der Spoel
Merge branch 'release-4-5-patches' into orderparm
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2010-10-08
David van der Spoel
Merge branch 'release-4-5-patches' of git.gromacs.org...
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2010-10-05
Berk Hess
renamed mdp setting Ace-approx to Ace-approximation
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2010-09-20
Per Larsson
Changes to GB non-polar solvation calculations
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2010-08-21
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
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2010-08-20
Sander Pronk
Added support for new mdp options controlling free...
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2010-07-29
Erik Lindahl
Merge branch 'master' of git.gromacs.org:gromacs
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2010-07-29
Berk
added 12-6 wall potential
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2010-06-09
Gerrit Groenhof
Merge branch 'master' into qmmm
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2010-04-27
Berk Hess
resolved merge conflicts
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2010-03-02
Roland Schulz
Merge branch 'release-4-0-patches'
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2010-01-05
Roland Schulz
Undo Michael's accidental commits with:
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2010-01-04
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-27
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-27
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-23
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-21
David van der Spoel
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-20
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-19
Michael Shirts
Committing to merge
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2009-12-19
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-17
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-17
Michael Shirts
Changed eiVV2 to eiVVAK, and "md-vv2" to "md-vv-avek...
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2009-12-05
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-04
Michael Shirts
Rewrite of the half-step ekin for velocity verlet,...
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2009-10-25
Michael Shirts
Made changes suggested by Berk.
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2009-09-26
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-09-23
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-09-17
David van der Spoel
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-09-16
Sander Pronk
Merge branch 'master' of git.gromacs.org:gromacs
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2009-09-15
Berk Hess
added pull geometry distance_periodic and reorganized...
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2009-09-09
Michael Shirts
Merge branch 'master' of git://git.gromacs.org/gromacs
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2009-09-07
Michael Shirts
A number of changes to gromacs_mrs. Almost working...
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2009-06-04
Erik Lindahl
Removed Id tags from master branch since they will...
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2009-02-23
pronk
Made cpp preprocessor work on .mdp files.
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2009-01-30
lindahl
Initial commit of generalized born electrostatics....
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2008-12-03
hess
Introduced generic charge-group - charge-group inner...
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2008-07-24
hess
implemented velocity rescaling thermostat and fixed...
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2008-05-29
lindahl
Added new generalized born parameters to tpr format.
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2008-04-11
hess
implemented checkpoint files
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2008-03-17
hess
implemented free-energy coupling options in grompp...
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2008-03-11
hess
implemented screw pbc
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2008-02-02
hess
removed a array from t_block for cgs and mols, renamed...
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2008-01-11
hess
made two separate sd integrator options
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2007-07-03
hess
added constant force pulling and many small checks...
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2007-05-08
hess
added coulombtype Reaction-Field-zero
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2007-04-21
hess
implemented two new scaling options for the posres...
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2007-03-30
hess
complete rewrite of the pull code, now works in paralle...
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2007-02-13
hess
added pbc=xy and walls, added a separate mdp option...
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2007-01-29
hess
added integrator tpic and fixed bugs for tpi with more...
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2006-08-17
hess
implemented PME-Switch electrostatics
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2006-04-19
lindahl
fatal.h clashes with system headers on AIX. Renamed...
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2006-03-24
hess
implemented proper local topologies for domain decompos...
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2005-09-02
lindahl
Last part of the QM-MM patch.
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2005-03-01
hess
implemented test particle insertion, activated the...
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2005-02-08
spoel
Added support for a combination of PME and User determi...
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2005-01-13
hess
for combination_rules 2 and 3 nonbonded_params and...
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2004-12-26
lindahl
Added tip4p water optimization, removed MNO solvent...
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2004-12-14
hess
renamed all dummy/dummies to vsite/vsites in all filena...
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2004-09-24
spoel
Added more info for debugging and testing.
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2004-08-28
lindahl
Added Encad shift functions to the table code.
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2004-08-10
hess
added reaction-field correction for excluded atom pairs...
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2004-01-23
lindahl
Added conditional inclusion of config.h to source files.
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2004-01-22
lindahl
Added Michael Shirts long-range dispersion and repulsio...
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2003-11-27
lindahl
Added support for L-BFGS minimization.
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2003-11-17
spoel
Upped the version to 3.2.0
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2002-12-04
spoel
Made use of graph optional (with epbcXYZ only) and...
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2002-11-06
lindahl
Partial commit of the project to remove all static...
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2002-02-28
spoel
Updated copyrgt wrapper
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2002-02-26
lindahl
Fixed minor bugs in PPC G3 detection.
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2002-02-18
hess
added a fit group for orientation restraining to fix...
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