Enforced rotation: PBC/restart fix
[alexxy/gromacs.git] / src / kernel / runner.c
2012-07-06 Carsten KutznerEnforced rotation: PBC/restart fix
2012-06-26 Roland SchulzMerge "Fix gmx_fatal for serial compilation" into relea...
2012-06-25 Szilard Pallintroduce gmx_omp wrapper for the OpenMP API
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
2012-06-01 Christoph JunghansMerge "Use External BLAS/LAPACK by default" into releas...
2012-05-24 Teemu MurtolaMerge "Code cleanup to avoid name collisions" into...
2012-05-17 Teemu MurtolaMerge "Fixing more clang warnings" into release-4-6
2012-05-17 Maarten Wolfmv membed.h from include to src/kernel
2012-05-09 Christoph JunghansMerge "Backporting "moving membed to mdrun" from master...
2012-05-08 Maarten WolfBackporting "moving membed to mdrun" from master
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 "Merge release-4-5-patches into release-4-6"...
2012-04-26 Berk HessMerge release-4-5-patches into release-4-6
2012-04-26 Szilárd PállMerge "fixed initial COM motion removal with multiple...
2012-04-26 David van der SpoelMerge "Various improvements to shell code" into release...
2012-04-25 Berk Hessreplaced PPPM by P3M-AD: a few lines in pme.c
2012-04-24 Berk HessMerge "allow -append to overrule unsupported file locki...
2012-04-23 Christoph JunghansMerge "compiler flag fixes" into release-4-6
2012-04-22 Roland SchulzMerge "enable command line option cheking in mdrun...
2012-04-18 Mark AbrahamRemoved outdated #includes
2012-04-18 Berk Hessallow -append to overrule unsupported file locking
2012-04-17 Mark AbrahamAdded Windows-specific #defines, and use them
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
2012-03-13 Roland SchulzMerge "mdrun -npme without PME or with PD now generates...
2012-03-13 Berk Hessmdrun -npme without PME or with PD now generates a...
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...
2012-02-09 Szilard Pallrenamed GMX_THREADS to GMX_THREAD_MPI
2012-02-08 Roland SchulzMerge remote-tracking branch 'gerrit/release-4-5-patche...
2012-02-08 Christoph JunghansMerge "fixed confusing nonbonded kernel pointer initial...
2012-02-03 Roland SchulzMerge remote-tracking branch 'gerrit/release-4-5-patche...
2012-02-03 David van der SpoelMerge "Improved the accuracy of the sd1 integrator...
2012-02-02 Szilárd PállMerge "Merges in threading branch as one squashed commi...
2012-02-02 Roland SchulzMerges in threading branch as one squashed commit
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
2011-12-26 Roland SchulzMerge remote-tracking branch 'gerrit/release-4-5-patche...
2011-12-20 Roland SchulzMerge release-4-5-patches into release-4-6
2011-12-19 Carsten KutznerEnforced rotation
2011-05-23 David van der SpoelMerge branch 'release-4-5-patches' of git@git.gromacs...
2011-05-17 Berk Hessfixed minor memory leak with particle decomposition...
2011-05-06 David van der SpoelMerge branch 'release-4-5-patches' of git@git.gromacs...
2011-05-05 Erik LindahlMerge branch 'release-4-5-patches' of git.gromacs.org...
2011-04-21 Erik MarklundMerge branch 'release-4-5-patches' of git@git.gromacs...
2011-04-20 Sander PronkNew thread_mpi library, with NUMA aware allocator for...
2011-04-14 Mark AbrahamMoved various support functions for do_md into mdlib
2011-01-30 David van der SpoelMerge branch 'release-4-5-patches' into orderparm
2010-11-08 Szilard PallMerge branch 'release-4-5-patches' of git.gromacs.org...
2010-11-07 Mark AbrahamMade mdrun exit with a fatal error for EM or NM with...
2010-10-28 David van der SpoelMerge branch 'release-4-5-patches' of git.gromacs.org...
2010-10-09 Erik LindahlMerge branch 'release-4-5-patches' of git.gromacs.org...
2010-10-08 Berk Hessmade combination of tpi and pme work again in parallel
2010-09-15 Berk Hessadded GMX_MAX_THREADS env.var. to set the maximum numbe...
2010-09-07 Berk Hessfixed crash with parallel nm with cut-off's
2010-08-25 Rossen ApostolovRedefine the default boolean type to gmx_bool.
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 Berk Hessmade mdrun -seppot work with threads and -seppot now...
2010-07-30 Erik LindahlMerge branch 'master' of git.gromacs.org:gromacs
2010-07-30 Sander PronkMerge branch 'master' of git.gromacs.org:gromacs
2010-07-30 Berkmade integrator nm work in parallel
2010-07-30 Berkcommented out nthreads and threadid in t_commrec to...
2010-07-21 Berkcorrected the order of the parallel inputrec and state...
2010-07-10 Michael ShirtsFixed minor formatting conflict.
2010-07-05 Maarten WolfMerge branch 'master' of git@git.gromacs.org:gromacs
2010-07-03 Roland Schulzruntime is only available on PP master (simmaster)...
2010-07-02 Roland Schulzintializing structs (to avoid valgrind error messages)
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
2010-06-11 Sander PronkMerge branch 'master' of git@git.gromacs.org:gromacs
2010-06-11 Berk Hessoptimized the number of threads
2010-06-11 Sander PronkFixed an allocation error during thread spawns.
2010-06-11 Sander PronkMerge branch 'threadspawn'
2010-06-11 Sander PronkCleaned up code that determines thread number.
2010-06-11 Sander PronkNumber of threads is now also determined by system...
2010-06-09 Gerrit GroenhofMerge branch 'master' into qmmm
2010-06-07 Erik MarklundMerge branch 'master' of git@git.gromacs.org:gromacs
2010-06-04 Erik MarklundMerge branch 'master' of git.gromacs.org:gromacs
2010-06-04 Carsten Kutznerfixed file appending for essential dynamics output...
2010-05-16 David van der SpoelMerge branch 'master' of git.gromacs.org:gromacs
2010-05-16 David van der SpoelMerge branch 'master' of git@git.gromacs.org:gromacs
2010-05-10 Sander PronkCleaned up signal handling code.
2010-05-07 Szilard PallMerge branch 'master' of git@git.gromacs.org:gromacs
2010-05-07 Berk HessMerge commit 'origin/2dpme'
2010-05-02 David van der SpoelMerge branch 'master' of git@git.gromacs.org:gromacs
2010-04-30 Berk HessMerge commit 'origin/master' into 2dpme
2010-04-30 Berk Hessfixed rest cycle count in serial
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