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alexxy/gromacs.git
2017-02-05 Mark AbrahamMerge branch release-5-1 into release-2016 commit | commitdiff | tree | snapshot
2017-02-03 David van der... Fixes SEGV in gmx order. commit | commitdiff | tree | snapshot
2017-02-02 Mark AbrahamClarify use of tau-p and pcoupltype commit | commitdiff | tree | snapshot
2017-02-02 Berk HessReally fix array of complex in cross_corr commit | commitdiff | tree | snapshot
2017-02-02 Berk HessFix array of complex in cross_corr commit | commitdiff | tree | snapshot
2017-01-31 Mark AbrahamMerge branch release-5-1 into release-2016 commit | commitdiff | tree | snapshot
2017-01-30 Mark AbrahamFix multi-domain reruns commit | commitdiff | tree | snapshot
2017-01-30 Mark AbrahamDon't print invalid performance data commit | commitdiff | tree | snapshot
2017-01-22 Mark AbrahamFixed gmx rmsf -q -oq. commit | commitdiff | tree | snapshot
2017-01-20 Berk HessDisallow overwriting of dihedral type 9 commit | commitdiff | tree | snapshot
2017-01-17 Berk HessCorrect assert on pme-order commit | commitdiff | tree | snapshot
2017-01-05 Roland SchulzSupress ICC 16 on Windows false postives commit | commitdiff | tree | snapshot
2017-01-05 Berk HessFix flat-bottom position restraints + DD + OpenMP commit | commitdiff | tree | snapshot
2017-01-05 Aleksei IupinovFix compilation with CMAKE_CXX_FLAGS="-Wall -Werror" commit | commitdiff | tree | snapshot
2017-01-05 Gerrit Code... Merge "Merge branch release-5-1 into release-2016"... commit | commitdiff | tree | snapshot
2017-01-04 Mark AbrahamStop trying to use objdump --reloc on Mac commit | commitdiff | tree | snapshot
2017-01-03 Mark AbrahamMerge branch release-5-1 into release-2016 commit | commitdiff | tree | snapshot
2016-12-20 Mark AbrahamCorrected documentation about eigenvalue handling commit | commitdiff | tree | snapshot
2016-12-20 Mark AbrahamImprove build system for plugin support commit | commitdiff | tree | snapshot
2016-12-15 M. Eric IrrgangFix syntax in cmake status message commit | commitdiff | tree | snapshot
2016-12-15 Vedran MiletićImprove include sorter error reporting commit | commitdiff | tree | snapshot
2016-12-15 Mark AbrahamHandle warninp correctly in xpm2ps and membed commit | commitdiff | tree | snapshot
2016-12-14 Mark AbrahamFix misleading parallelization docs for gmx wham commit | commitdiff | tree | snapshot
2016-12-14 Berk HessAdd bonded #thread runtime check commit | commitdiff | tree | snapshot
2016-12-10 Teemu MurtolaBuild scripts for improved release workflow commit | commitdiff | tree | snapshot
2016-12-09 Mark AbrahamFix logic of TRR reading commit | commitdiff | tree | snapshot
2016-12-09 Szilárd PállTurn off hwloc support when static lib found commit | commitdiff | tree | snapshot
2016-12-08 Teemu MurtolaFix possible memory error with long selections commit | commitdiff | tree | snapshot
2016-12-08 Vedran MiletićMake editconf B-factor attachment more useful in practice commit | commitdiff | tree | snapshot
2016-12-07 Teemu MurtolaFix use of position variables with plus/merge commit | commitdiff | tree | snapshot
2016-12-07 Mark AbrahamFix memory handling in gmx dump of TNG files commit | commitdiff | tree | snapshot
2016-12-05 Mark AbrahamRemove undue narrowing of integer in TNG reading commit | commitdiff | tree | snapshot
2016-12-01 Mark AbrahamFix minor trjconv bug commit | commitdiff | tree | snapshot
2016-11-29 Teemu MurtolaAdditional selection help commit | commitdiff | tree | snapshot
2016-11-17 Szilárd PállCorrect kernel launch bounds for CUDA sm_60 commit | commitdiff | tree | snapshot
2016-11-16 Carsten KutznerIncreased the default reset step to 1500 in gmx tune_pme commit | commitdiff | tree | snapshot
2016-11-15 Carsten KutznerFixed typo in membed.cpp commit | commitdiff | tree | snapshot
2016-11-10 Christoph Junghanscmake: fix build with GMX_EXTERNAL_TNG=ON commit | commitdiff | tree | snapshot
2016-11-08 Dan HorákFix x86 conditional commit | commitdiff | tree | snapshot
2016-11-01 Berk HessFix time label print in gmx vanhove commit | commitdiff | tree | snapshot
2016-10-28 Mark AbrahamBumped version to prepare for next patch release commit | commitdiff | tree | snapshot
2016-10-28 Mark AbrahamVersion 2016.1 commit | commitdiff | tree | snapshot
2016-10-28 Berk HessDLB can now turn off, when slower commit | commitdiff | tree | snapshot
2016-10-28 Szilárd PállGPU-related additions to the install/user guide commit | commitdiff | tree | snapshot
2016-10-28 Berk HessFix DLB timing with CUDA and OpenCL commit | commitdiff | tree | snapshot
2016-10-27 Szilárd PállMake -cl-fast-relaxed-math default commit | commitdiff | tree | snapshot
2016-10-26 Szilárd PállAdd GMX_DISABLE_GPU_TIMING env var commit | commitdiff | tree | snapshot
2016-10-21 Mark AbrahamUpdate install guide commit | commitdiff | tree | snapshot
2016-10-18 Mark AbrahamFix SIMD suggestion for VMX commit | commitdiff | tree | snapshot
2016-10-12 James W. BarnettSet maxwarn to INT_MAX if GMX_MAXCONSTRWARN < 0 commit | commitdiff | tree | snapshot
2016-10-12 Berk HessFixed print bug in gmx wham commit | commitdiff | tree | snapshot
2016-10-11 James W. Barnettfix typo commit | commitdiff | tree | snapshot
2016-10-11 Mark AbrahamUpdate for FFTW 3.3.5 commit | commitdiff | tree | snapshot
2016-10-09 Szilárd PállCorrect kernel launch bounds for CUDA sm_60 commit | commitdiff | tree | snapshot
2016-10-07 Mark AbrahamAdd script for Jenkins regressiontest update job commit | commitdiff | tree | snapshot
2016-10-06 Carlo CamilloniAlways update mdatoms when doing energy minimisation commit | commitdiff | tree | snapshot
2016-10-05 Teemu MurtolaMerge "Merge branch release-5-1 into release-2016"... commit | commitdiff | tree | snapshot
2016-10-03 Mark AbrahamMerge branch release-5-1 into release-2016 commit | commitdiff | tree | snapshot
2016-10-03 Mark AbrahamReplace use of deprecated readdir_r commit | commitdiff | tree | snapshot
2016-10-03 Justin LemkulFix incorrect charge in HISE. commit | commitdiff | tree | snapshot
2016-09-28 Jochen HubFixed bug in gmx wham for reading pullx files. commit | commitdiff | tree | snapshot
2016-09-27 David van der... Fixed script xplor2gmx.pl to work with GMXDATA commit | commitdiff | tree | snapshot
2016-09-24 Teemu MurtolaFix default nice level in mdrun-only build commit | commitdiff | tree | snapshot
2016-09-18 Roland SchulzFix math-test false positive commit | commitdiff | tree | snapshot
2016-09-16 Berk HessFixed unused variables in domdec.cpp commit | commitdiff | tree | snapshot
2016-09-16 Berk HessMade distance restraints work with threads and DD commit | commitdiff | tree | snapshot
2016-09-12 Vedran MiletićDocument wallcycle counters and subcounters commit | commitdiff | tree | snapshot
2016-09-11 Vedran MiletićPrint OpenCL error string instead of error code commit | commitdiff | tree | snapshot
2016-09-08 Mark AbrahamMerge branch release-5-1 into release-2016 commit | commitdiff | tree | snapshot
2016-09-08 Mark AbrahamBumped patch number to prepare for future 5.1.5 release commit | commitdiff | tree | snapshot
2016-09-07 Mark AbrahamVersion 5.1.4 commit | commitdiff | tree | snapshot
2016-09-07 Mark AbrahamRemoved HIS1 from oplsaa and charmm definitions commit | commitdiff | tree | snapshot
2016-09-07 Mark AbrahamFix LYN charges in amber03 commit | commitdiff | tree | snapshot
2016-09-07 Mark AbrahamFix amber03 HIP charges commit | commitdiff | tree | snapshot
2016-09-06 Mark AbrahamWork around glibc 2.23 with CUDA commit | commitdiff | tree | snapshot
2016-09-06 Berk HessFix bug with conjugate-gradient and OpenMP commit | commitdiff | tree | snapshot
2016-09-05 Berk HessRe-enable flexible constraints with DD commit | commitdiff | tree | snapshot
2016-09-02 Berk HessMerge branch release-5-1 into release-2016 commit | commitdiff | tree | snapshot
2016-09-02 Berk HessFix Parrinello-Rahman with nstpcouple>1 commit | commitdiff | tree | snapshot
2016-08-30 Berk HessMake virial reproducible commit | commitdiff | tree | snapshot
2016-08-27 Mark AbrahamStop using gmx_fatal in grompp commit | commitdiff | tree | snapshot
2016-08-27 Roland SchulzFix build with GMX_USE_TNG=off commit | commitdiff | tree | snapshot
2016-08-25 Jochen HubFixed bug in gmx insert-molecules. commit | commitdiff | tree | snapshot
2016-08-24 Berk HessFix Ewald surface+3DC corrections commit | commitdiff | tree | snapshot
2016-08-24 Berk HessMerge branch release-5-1 into release-2016 commit | commitdiff | tree | snapshot
2016-08-23 Berk HessRemove variable precision gro writing commit | commitdiff | tree | snapshot
2016-08-17 Berk HessFixed opening of wall table files commit | commitdiff | tree | snapshot
2016-08-15 Mark AbrahamFixes for BG/Q platform files and install guide commit | commitdiff | tree | snapshot
2016-08-15 Berk HessReduce FE pair-list memory usage commit | commitdiff | tree | snapshot
2016-08-12 Mark AbrahamBump number to prepare for first patch release commit | commitdiff | tree | snapshot
2016-08-10 Berk HessFix deadlock with thread-MPI commit | commitdiff | tree | snapshot
2016-08-09 Berk HessFix twin-cutoff for GPU LJ pot-switch commit | commitdiff | tree | snapshot
2016-08-04 Mark AbrahamVersion 2016 commit | commitdiff | tree | snapshot
2016-08-04 Teemu MurtolaFix/improve doc links in template/README commit | commitdiff | tree | snapshot
2016-08-03 David van der... Three new quotes. commit | commitdiff | tree | snapshot
2016-08-03 Vedran MiletićUse only legal characters in OpenCL cache filename commit | commitdiff | tree | snapshot
2016-07-31 David van der... Merge "Merge branch release-5-1 into release-2016"... commit | commitdiff | tree | snapshot
2016-07-30 Vedran MiletićDocument gmx_cgsort_t and gmx_domdec_sort_t structs commit | commitdiff | tree | snapshot
2016-07-29 Mark AbrahamImprove handling of gmock and gcc6 commit | commitdiff | tree | snapshot
2016-07-29 Mark AbrahamMerge branch release-5-1 into release-2016 commit | commitdiff | tree | snapshot
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