added Verlet scheme and NxN non-bonded functionality
[alexxy/gromacs.git] / src / mdlib / forcerec.c
2012-10-02 Szilard Palladded Verlet scheme and NxN non-bonded functionality
2012-10-01 Roland SchulzMerge release-4-5-patches into release-4-6
2012-09-03 Szilard PallMerge branch 'release-4-5-patches' into release-4-6
2012-07-25 Roland SchulzMerge "cmake: allow switch between single and double...
2012-07-25 Roland SchulzMerge "fix a segfault in sse_mask_init" into release-4-6
2012-07-24 Mark AbrahamClean up of environment variables
2012-07-13 Roland SchulzMerge release-4.5-patches into HEAD
2012-06-26 Roland SchulzMerge "Fix gmx_fatal for serial compilation" into relea...
2012-06-25 Berk Hessadded check for log fp!=NULL when disabling acceleration
2012-06-24 Michael ShirtsMerge "Fix mdp_opt formatting of expanded ensemble...
2012-06-22 Christoph JunghansMerge "Simple patch for openmm_wrapper.cpp" into releas...
2012-06-16 Erik LindahlNew CPU detection & AVX/SSE code, removed raw assembly...
2012-06-04 Michael ShirtsMerging in free energy, exp. ensemble, & andersen t...
2012-06-01 Roland SchulzMerge release-4-5-patches into release-4-6
2012-05-07 Teemu MurtolaMerge branch 'gerrit/release-4-5-patches' into release-4-6
2012-04-29 Roland SchulzMerge release-4-5-patches into release-4-6
2012-04-29 Roland SchulzMerge release-4-5-patches into release-4-6
2012-04-26 Berk HessMerge release-4-5-patches into release-4-6
2012-04-25 Berk Hessreplaced PPPM by P3M-AD: a few lines in pme.c
2012-04-03 Roland SchulzMerge remote-tracking branch 'gerrit/release-4-5-patche...
2012-03-28 Szilard PallMerge branch 'release-4-5-patches' into release-4-6
2012-03-18 David van der SpoelMerge "Merge release-4-5-patches into release-4-6"...
2012-03-16 Berk Hessfixed incorrect table allocation
2012-03-16 Roland SchulzMerge release-4-5-patches into release-4-6
2012-03-15 Roland SchulzFix most errors found by cppcheck
2012-02-29 Szilard PallMerge branch 'release-4-5-patches' into release-4-6
2012-02-23 Roland SchulzMerge remote-tracking branch 'gerrit/release-4-5-patche...
2012-02-08 Roland SchulzMerge remote-tracking branch 'gerrit/release-4-5-patche...
2012-02-03 Roland SchulzMerge remote-tracking branch 'gerrit/release-4-5-patche...
2012-02-02 Szilárd PállMerge "Merges in threading branch as one squashed commi...
2012-02-01 Christoph Junghansinitialize adress_do_hybridpairs=FALSE by default
2012-01-19 Roland SchulzMerge release-4-5-patches into release-4-6
2012-01-13 Roland SchulzMerge "Fixed MSVC compiling with plug-in support" into...
2012-01-10 Christoph JunghansAdds AdResS feature to gromacs
2011-08-12 Berk Hessimplemented full exclusion support for the charge-group...
2011-07-01 David van der SpoelMerge branch 'release-4-5-patches' of git@git.gromacs...
2011-07-01 Justin A. LemkulFixed PME citation.
2011-01-30 David van der SpoelMerge branch 'release-4-5-patches' into orderparm
2010-10-28 David van der SpoelMerge branch 'release-4-5-patches' of git.gromacs.org...
2010-10-12 Berk Hessfixed incorrect dispersion correction for TPI with...
2010-08-30 Christoph Junghansforcerec.c: added missing int
2010-08-27 Erik LindahlMerge branch 'release-4-5-patches' of git.gromacs.org...
2010-08-27 Erik LindahlAdded check for SSE2 support to use generalized born...
2010-08-25 Rossen ApostolovRedefine the default boolean type to gmx_bool.
2010-08-18 Michael ShirtsMerge branch 'release-4-5-patches' of git@git.gromacs...
2010-08-18 Erik LindahlMerge branch 'release-4-5-patches' of git.gromacs.org...
2010-08-18 Erik LindahlEnabled double precision all-vs-all kernels. Tested...
2010-08-17 Michael ShirtsMerge branch 'release-4-5-patches' of git@git.gromacs...
2010-08-10 Erik LindahlMerge branch 'release-4-5-patches' of git.gromacs.org...
2010-08-09 Berkenv.var. GMX_NB_GENERIC no turns off solvent optimizati...
2010-08-09 Berkadded exclusion check for cg-cg innerloops
2010-08-06 Erik LindahlMerge branch 'release-4-5-patches' of git.gromacs.org...
2010-08-05 Berk Hesssc_sigma now also sets the minimum value for the soft...
2010-07-26 Sander PronkMerge branch 'master' of git.gromacs.org:gromacs
2010-07-26 Erik LindahlMerge branch 'master' of git.gromacs.org:gromacs
2010-07-26 Erik LindahlMerge branch 'master' of git.gromacs.org:gromacs
2010-07-26 Erik LindahlAdded files in preparation of double-precision AllvsAll...
2010-07-26 Berk Hessadded natoms_force_constr to t_forcerec
2010-07-25 Erik LindahlResolved merge conflict
2010-07-25 Erik LindahlFixed bug for small systems in all-vs-all kernels,...
2010-07-10 Michael ShirtsFixed minor formatting conflict.
2010-07-05 Maarten WolfMerge branch 'master' of git@git.gromacs.org:gromacs
2010-07-02 David van der SpoelMerge branch 'master' of git.gromacs.org:gromacs
2010-07-02 Rossen ApostolovMerge branch 'master' of git.gromacs.org:gromacs
2010-07-02 Rossen ApostolovDisable AllvsAll kernels for very small systems (<...
2010-06-20 Michael ShirtsMerge branch 'master' of git@git.gromacs.org:gromacs
2010-06-18 Gerrit GroenhofMerge branch 'master' into qmmm
2010-06-17 Maarten WolfMerge branch 'master' of git@git.gromacs.org:gromacs
2010-06-17 Szilard PallMerge branch 'master' of git@git.gromacs.org:gromacs
2010-06-16 kassonMerge branch 'mymaster'
2010-06-15 Berk Hessallvsall loops now trigger particle decomposition
2010-06-09 Gerrit GroenhofMerge branch 'master' into qmmm
2010-04-27 Berk Hessresolved merge conflicts
2010-03-02 Roland SchulzMerge branch 'release-4-0-patches'
2010-02-18 Berkremoved some double initialization code in mdrun
2010-01-26 David van der SpoelMerge branch 'master' of git.gromacs.org:gromacs
2010-01-26 David van der Spoelclarified comment about water optimization
2010-01-26 Per LarssonMerge branch 'master' of git.gromacs.org:gromacs
2010-01-26 Berk Hessfixed some comments in forcerec.c
2010-01-05 Roland SchulzUndo Michael's accidental commits with:
2010-01-04 Michael ShirtsMerge branch 'master' of git@git.gromacs.org:gromacs
2010-01-01 Michael ShirtsLatest revision of free energy changes.
2009-12-27 Michael ShirtsMerge branch 'master' of git@git.gromacs.org:gromacs
2009-12-27 Michael ShirtsMerge branch 'master' of git@git.gromacs.org:gromacs
2009-12-23 Michael ShirtsMerge branch 'master' of git@git.gromacs.org:gromacs
2009-12-20 Michael ShirtsMerge branch 'master' of git@git.gromacs.org:gromacs
2009-12-19 Michael ShirtsCommitting to merge
2009-12-17 Michael ShirtsMerge branch 'master' of git@git.gromacs.org:gromacs
2009-12-15 Roland SchulzMerge branch '2dpme' of git@git.gromacs.org:gromacs...
2009-12-15 Berk Hessmerged with master
2009-12-14 David van der SpoelMerge branch 'master' of git@git.gromacs.org:gromacs
2009-12-11 Peter KassonMerge branch 'master' of git@git.gromacs.org:gromacs
2009-12-11 Erik LindahlMerge branch 'master' of git.gromacs.org:gromacs
2009-12-11 Per LarssonIncreased range and density in GB table
2009-12-05 Michael ShirtsMerge branch 'master' of git@git.gromacs.org:gromacs
2009-11-27 Michael ShirtsMerge branch 'master' of git@git.gromacs.org:gromacs
2009-10-16 David van der SpoelMerge branch 'master' of git@git.gromacs.org:gromacs
2009-10-08 Erik LindahlMerge branch 'master' of git.gromacs.org:gromacs
2009-10-08 Berk Hesssplit force.c into forcerec.c and force.c and added...