added Verlet scheme and NxN non-bonded functionality
[alexxy/gromacs.git] / include / types / nrnb.h
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
2012-07-13 Roland SchulzMerge release-4.5-patches into HEAD
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
2012-04-03 Roland SchulzMerge remote-tracking branch 'gerrit/release-4-5-patche...
2012-03-28 Szilard PallMerge branch 'release-4-5-patches' into release-4-6
2012-03-16 Roland SchulzMerge release-4-5-patches into release-4-6
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...
2012-01-25 Roland SchulzMerge "Merge release-4-5-patches into release-4-6"...
2012-01-25 Berk HessMerge "Added two new bonded functions." into release-4-6
2012-01-25 David van der SpoelAdded two new bonded functions.
2011-01-30 David van der SpoelMerge branch 'release-4-5-patches' into orderparm
2010-08-23 Rossen ApostolovMerge branch 'release-4-5-patches' of git.gromacs.org...
2010-08-22 Erik LindahlMerge branch 'release-4-5-patches' of git.gromacs.org...
2010-08-22 Erik LindahlCleaned up all installed headers to remove strict depen...
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'
2010-01-19 David van der SpoelMerge branch 'master' of git@git.gromacs.org:gromacs
2010-01-07 Michael ShirtsMerge branch 'master' of git://git.gromacs.org/gromacs
2010-01-04 Michael ShirtsMerge branch 'master' of git@git.gromacs.org:gromacs
2010-01-04 Berk Hessimplemented restraint bonds
2009-12-20 Michael ShirtsMerge branch 'master' of git@git.gromacs.org:gromacs
2009-12-05 Michael ShirtsMerge branch 'master' of git@git.gromacs.org:gromacs
2009-11-30 David van der SpoelMerge branch 'master' of git@git.gromacs.org:gromacs
2009-11-27 Roland SchulzMerge branch 'master' of git@git.gromacs.org:gromacs
2009-11-27 Sander PronkC++ fixes: fixed 'extern "C"' in header files m-z.
2009-09-23 Michael ShirtsMerge branch 'master' of git@git.gromacs.org:gromacs
2009-09-14 David van der SpoelMerge branch 'master' of git@git.gromacs.org:gromacs
2009-09-14 David van der SpoelMerge branch 'master' of git.gromacs.org:gromacs
2009-09-12 Roland SchulzMerge branch 'master' of git@git.gromacs.org:gromacs
2009-09-09 Michael ShirtsMerge branch 'master' of git://git.gromacs.org/gromacs
2009-09-09 Erik LindahlMerge branch 'master' of git.gromacs.org:gromacs
2009-09-09 Erik LindahlNew all-vs-all loops and working SSE gb kernels+radii...
2009-08-31 David van der SpoelMerge branch 'master' of git@git.gromacs.org:gromacs
2009-08-30 kassonTool merge
2009-08-30 Erik LindahlInitial all-vs-all kernels. Single precision SSE working.
2009-06-04 Erik LindahlRemoved Id tags from master branch since they will...
2009-04-21 lindahlInitial CMAP support commit.
2009-01-30 lindahlInitial commit of generalized born electrostatics....
2008-01-04 hessmerged vsite_cog and vsite_com into vsiten
2008-01-04 hessimplemented COG and COM vsites
2007-10-01 lindahlAdded new 4FDN vsite type that should be more stable...
2007-02-13 hessadded pbc=xy and walls, added a separate mdp option...
2006-12-08 hessimplemented tabulated bonded potentials
2006-11-01 hessimplemented cycle counting for the main parts of mdrun
2005-08-29 lindahlChanged order of free energy and outer loop flopcount...
2005-08-24 lindahlAdded innerloop type identifiers to the neighborlists...
2005-06-03 spoelAdded a new polarization type: Thole polarization for...
2005-03-01 hessimplemented test particle insertion, activated the...
2004-12-26 lindahlAdded FENE_BONDS entry.
2004-12-26 lindahlRemoved duplicate eNR_ANGLES entry added by mistake...
2004-12-26 lindahlAdded new nonbonded kernel setup to nrnb entries.
2004-12-15 hessadded FENE bond and quartic angle potentials and slight...
2004-12-14 hessrenamed all dummy/dummies to vsite/vsites in all filena...
2004-06-22 hessfixed incorrect innerloop choice with free-energy=yes...
2003-11-17 spoelUpped the version to 3.2.0
2002-11-06 lindahlPartial commit of the project to remove all static...
2002-02-28 spoelUpdated copyrgt
2002-01-25 hessadded orientation restraints, extended the energy file...
2001-05-14 lindahlTagged files with gromacs 3.0 header and added some...
2001-03-02 lindahlTransfer of the entire build system to autoconf/automake.
2000-09-14 hessfixed several problems with the MNO solvent loops
2000-09-14 hessCommitted the new innerloops for Erik Lindahl
2000-08-22 lindahlIntroduced Nose-Hoover and Parinello-Rahman extended...
2000-04-12 spoelAdded constant
1999-11-03 hesscopyrgted
1999-11-02 hessremoved the fixed loop length of 4 in the lincs innerlo...
1999-11-01 spoelAdded mflops counting for lincs, and fixed some type...
1999-07-29 spoelA number of minor changes and small bugfixes. g_rmsf...
1999-07-26 lindahlAdded terms for PME & Ewald electrostatics
1999-06-04 hessadded angle restraints
1999-05-25 spoelChanged many files to be able to use the new inner...
1999-02-03 hessrenamed and added dummies and changed a lot of NMR...
1998-11-30 spoelAdded code for water polarizibility potential
1998-08-05 antonadded eNR_DUM2FD/FAD, removed eNR_DUM4
1997-11-03 spoelInitial revision