alexxy/gromacs.git
2011-01-04 Carsten KutznerMerge branch 'release-4-5-patches'
2011-01-04 ckutzneFixed inconvenient output file names if -sep is used...
2011-01-04 Berk Hessfixed grompp looking for include files in double relati...
2011-01-03 Teemu MurtolaMerge branch 'cpp-migration'
2011-01-03 Teemu MurtolaAdded g_select for the new framework.
2010-12-26 Teemu MurtolaRemoved an obsolete file.
2010-12-26 Teemu MurtolaFixed issues with header installation.
2010-12-26 Teemu MurtolaMerge branch 'cpp-analysis'
2010-12-26 Teemu MurtolaMerge commit '0e52c9073c31ddc1cdc23f0cbf867ad1c9e72524...
2010-12-26 Teemu MurtolaMoved selection and trajana modules to src/gromacs/.
2010-12-26 Teemu MurtolaMerge commit '4d39dbdaa88b63df182fb3ca1d9133f2809277c1...
2010-12-26 Teemu MurtolaMerge branch 'release-4-5-patches'
2010-12-26 Teemu MurtolaDeleted leftover files from the migration.
2010-12-26 Teemu MurtolaRemoved autoconf files from moved directories.
2010-12-23 David van der... Merge branch 'release-4-5-patches'
2010-12-23 David van der... Fixed bug in statistics which did not allow fitting...
2010-12-22 Berk Hessremoved incorrect citation print of Engin2010 for pull...
2010-12-21 Berk Hesspme.c work-around for MPI fatal error in pme with partt...
2010-12-16 Berk Hessfixed incorrect LJ table in mdrun with reppow!=12
2010-12-16 Berk Hessremoved editconf warning on box distance with -bt
2010-12-16 Rossen ApostolovAnother test commit
2010-12-15 Rossen ApostolovTest commit
2010-12-13 Berk Hessfixed tpbconv time options leading to negative nsteps...
2010-12-11 David van der... Merge branch 'release-4-5-patches'
2010-12-11 David van der... Merge branch 'release-4-5-patches' of git.gromacs.org...
2010-12-11 David van der... Merge branch 'master' of git.gromacs.org:gromacs
2010-12-11 David van der... Merge branch 'release-4-5-patches'
2010-12-11 David van der... Added 1 quote.
2010-12-10 Pär BjelkmarAdded CHARMM neutral lysine, LYN, to residuetypes.dat.
2010-12-10 Christoph JunghansFixed wrong path ordering in GMX.bash introduced in...
2010-12-09 David van der... Merge branch 'release-4-5-patches'
2010-12-09 David van der... Added fatal error for when people use energy files...
2010-12-06 Mark AbrahamAdded comments and workaround for IBM's BlueGene(/L...
2010-12-02 Carsten KutznerMerge branch 'release-4-5-patches'
2010-12-02 ckutzneFixed typo.
2010-11-30 Carsten KutznerMerge branch 'master' of git.gromacs.org:gromacs
2010-11-30 ckutzneProper appending with enforced rotation output files.
2010-11-29 Christoph JunghansGMXRC.* - fixed bug #614
2010-11-29 Christoph Junghansadded power6 flags from Markus Rampp
2010-11-28 David van der... Merge branch 'release-4-5-patches'
2010-11-28 David van der... Fixed bugzilla 616 about formatting in the help text.
2010-11-26 David van der... Fixed SEGV bug in g_sham.
2010-11-26 Carsten KutznerEnforced rotation: fixed torque calculation for FLEX...
2010-11-24 Berk Hessfixed segv in grompp due to gmxcpp not checking for...
2010-11-24 Christoph Junghansconfigure: build shared libs unless mpi enabled (bug...
2010-11-23 Carsten KutznerMerge branch 'master' of git.gromacs.org:gromacs
2010-11-23 Carsten KutznerEnforced rotation: code cleanup
2010-11-22 Mark AbrahamAdded a hint to the documentation for creating .tpr...
2010-11-19 ckutzneFixed segv in gmx_pme_error when gromacs compiled with...
2010-11-19 Sander PronkFixed TMPI_WAIT_FOR_NO_ONE deadlock.
2010-11-18 David van der... Made printing in check_multi_init conditional, dependin...
2010-11-18 Carsten KutznerBetter description of rotation options
2010-11-17 Teemu MurtolaMoved src/gmxlib/ to src/gromacs/gmxlib/.
2010-11-17 Teemu MurtolaMoved src/mdlib/ to src/gromacs/mdlib/.
2010-11-17 Teemu MurtolaMoved include/ to src/gromacs/legacyheaders/.
2010-11-17 Carsten KutznerRemoved unnecessary include
2010-11-17 Carsten KutznerMerge branch 'rotation'
2010-11-17 Carsten KutznerMerge branch 'release-4-5-patches'
2010-11-15 Carsten KutznerMerge branch 'rotation-4-5' into rotation
2010-11-15 Carsten KutznerEnforced rotation: define Gaussian norm
2010-11-15 Carsten KutznerMerge branch 'rotation-4-5' into rotation
2010-11-15 Carsten KutznerEnforced rotation: use the right tpx_version
2010-11-15 Carsten KutznerEnforced rotation: set the right tpx_version
2010-11-15 Carsten KutznerMerge branch 'release-4-5-patches' into rotation-4-5
2010-11-12 Mark AbrahamMinor trjconv documentation formatting fix
2010-11-12 Mark Abrahamg_densmap -od writes a .dat file and prevents writing...
2010-11-09 Rossen ApostolovNew maintanance release: 4.5.3
2010-11-09 Berk Hessadded -resnr option to editconf
2010-11-09 Mark AbrahamGMX_POWERPC_INVSQRT should be OFF in CMakeLists.txt...
2010-11-09 Berk Hessfixed compiler warning in pdb2gmx.c
2010-11-08 Rossen ApostolovReverting back GMX_DLOPEN to default ON
2010-11-08 Roland Schulzmaking error message for vmdio clearer (bug 598)
2010-11-08 Pär BjelkmarDeleted redundant charmm27.ff/dna.r2b.
2010-11-08 Rossen ApostolovDisable GMX_DLOPEN by default.
2010-11-08 Rossen ApostolovAdded support for Altivec kernels on POWERPC.
2010-11-08 Szilard PallMerge branch 'release-4-5-patches' of git.gromacs.org...
2010-11-08 Carsten KutznerMerge branch 'master' into rotation
2010-11-08 Carsten KutznerMerge branch 'rotation-4-5' into rotation
2010-11-08 Carsten KutznerEnforced rotatin: Put in check for acos value; enhanced...
2010-11-08 Carsten KutznerMerge branch 'release-4-5-patches' into rotation-4-5
2010-11-07 Mark AbrahamMade mdrun exit with a fatal error for EM or NM with...
2010-11-06 Mark AbrahamFixed .xvg legends for g_sas options -or and -oa
2010-11-05 Szilard PallMerge branch 'release-4-5-patches' of git.gromacs.org...
2010-11-05 Teemu MurtolaMerge branch 'release-4-5-patches'
2010-11-05 David van der... Fixed compilation issue.
2010-11-05 David van der... Fixed compilation issue.
2010-11-05 David van der... Added flag to gmx_stats_get_point
2010-11-05 Pär BjelkmarMore atom-based charge groups in CHARMM (termini and...
2010-11-05 Carsten KutznerMerge branch 'rotation-4-5' into rotation
2010-11-05 Carsten KutznerFlexible RMSD fitting is now optionally mass-weighted
2010-11-05 Carsten KutznerPrint warning when reference file is set but could...
2010-11-05 Berk Hesspdb2gmx now puts atoms with cgnr=-1 in separate charge...
2010-11-05 Carsten KutznerMerge branch 'release-4-5-patches' into rotation-4-5
2010-11-04 Roland Schulzprint more information in case of lock error
2010-11-04 Carsten KutznerMerge branch 'rotation-4-5' into rotation
2010-11-04 Carsten KutznerDoxygen comment for dd_make_local_rotation_groups
2010-11-04 Berk HessFixed md.log being opened twice when appending, which...
2010-11-04 Carsten KutznerMerge branch 'master' into rotation
2010-11-04 Carsten KutznerMerge branch 'release-4-5-patches' into rotation-4-5
2010-11-04 Carsten KutznerMerge branch 'rotation-4-5' into rotation
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