BioD PNPI Git Repos - alexxy/gromacs.git/history

biod.pnpi.spb.ru / alexxy / gromacs.git / history

[alexxy/gromacs.git] / src / programs / mdrun / md.c

2014-09-30	Berk Hess	Avoid DLB with overloaded PME ranks	blob \| commitdiff \| raw
2014-09-29	Roland Schulz	Merge release-4-6 into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-09-18	Mark Abraham	Merge branch release-4-6 into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-09-01	Magnus Lundborg	When writing TNG include file closing in wallcycle.	blob \| commitdiff \| raw \| diff to current
2014-09-01	Mark Abraham	Merge branch release-4-6 into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-08-29	Mark Abraham	Merge branch release-4-6 into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-08-16	Mark Abraham	Fix wallcycle counting with md-vv, sd and sd2	blob \| commitdiff \| raw \| diff to current
2014-08-10	Roland Schulz	Merge release-4-6 into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-06-29	Roland Schulz	Merge release-4-6 into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-06-28	Mark Abraham	Merge branch 'release-4-6' into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-06-27	Roland Schulz	Merge release-4-6 into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-06-26	Roland Schulz	Merge release-4-6 into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-06-11	Berk Hess	Decoupled repl_ex_nst from nstcalcenergy	blob \| commitdiff \| raw \| diff to current
2014-06-06	Mark Abraham	Merge release-4-6 into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-05-27	Roland Schulz	Merge release-4-6 into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-05-10	Roland Schulz	Merge release-4-6 into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-04-29	Mark Abraham	Merge branch release-4-6 into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-04-10	Mark Abraham	Merge branch 'release-4-6' into release-5-0	blob \| commitdiff \| raw \| diff to current
2014-04-02	Teemu Murtola	Move string2.* to utility/cstringutil.*	blob \| commitdiff \| raw \| diff to current
2014-04-01	Teemu Murtola	Move smalloc.h to utility/	blob \| commitdiff \| raw \| diff to current
2014-03-26	Martin Hoefling	Interactive Molecular Dynamics (IMD)	blob \| commitdiff \| raw \| diff to current
2014-03-24	Teemu Murtola	Remove gmxpreprocess from include path	blob \| commitdiff \| raw \| diff to current
2014-03-23	Mark Abraham	Merge branch release-4-6	blob \| commitdiff \| raw \| diff to current
2014-03-23	Mark Abraham	Fix print_date_and_time	blob \| commitdiff \| raw \| diff to current
2014-03-18	Roland Schulz	Fix dependencies on config.h for typedefs.h	blob \| commitdiff \| raw \| diff to current
2014-03-17	Mark Abraham	Merge branch release-4-6	blob \| commitdiff \| raw \| diff to current
2014-03-11	Berk Hess	PME load balancing now works with LJ-PME	blob \| commitdiff \| raw \| diff to current
2014-03-03	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2014-02-26	Berk Hess	Free-energy now works with the Verlet scheme	blob \| commitdiff \| raw \| diff to current
2014-02-26	Roland Schulz	Replace all mdrun rngs with cycle based rng	blob \| commitdiff \| raw \| diff to current
2014-02-21	Roland Schulz	Merge "Merge release-4-6 into master"	blob \| commitdiff \| raw \| diff to current
2014-02-21	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2014-02-20	Mark Abraham	Remove particle decomposition	blob \| commitdiff \| raw \| diff to current
2014-02-02	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2014-01-29	Teemu Murtola	Merge "Merge branch 'release-4-6'"	blob \| commitdiff \| raw \| diff to current
2014-01-28	Mark Abraham	Merge branch 'release-4-6'	blob \| commitdiff \| raw \| diff to current
2014-01-28	Carsten Kutzner	Allow for "computational electrophysiology" simulations...	blob \| commitdiff \| raw \| diff to current
2014-01-20	Magnus Lundborg	Add TNG writing and reading support	blob \| commitdiff \| raw \| diff to current
2014-01-17	David van der Spoel	This patch moves preprocessing headers to gmxpreprocess	blob \| commitdiff \| raw \| diff to current
2014-01-13	Carsten Kutzner	Move pull code to separate subdirectory	blob \| commitdiff \| raw \| diff to current
2014-01-09	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2014-01-01	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2013-12-23	Roland Schulz	Replace gmx_large_int_t with gmx_int64_t	blob \| commitdiff \| raw \| diff to current
2013-12-21	Teemu Murtola	Move parse_common_args() into commandline/pargs.*	blob \| commitdiff \| raw \| diff to current
2013-12-02	Roland Schulz	Merge "Merge branch 'release-4-6'"	blob \| commitdiff \| raw \| diff to current
2013-12-02	Christian Wennberg	Calculating LJ-interactions using Particle mesh Ewald	blob \| commitdiff \| raw \| diff to current
2013-12-02	Mark Abraham	Merge branch 'release-4-6'	blob \| commitdiff \| raw \| diff to current
2013-12-01	Teemu Murtola	Adjust more copyright headers	blob \| commitdiff \| raw \| diff to current
2013-11-26	Teemu Murtola	Remove #ifdef GMX_THREAD_MPI for basic thread safety.	blob \| commitdiff \| raw \| diff to current
2013-11-15	Mark Abraham	Merge branch release-4-6	blob \| commitdiff \| raw \| diff to current
2013-10-31	Teemu Murtola	Move more timing routines into timing/.	blob \| commitdiff \| raw \| diff to current
2013-10-30	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2013-10-28	Mark Abraham	Create fileio module	blob \| commitdiff \| raw \| diff to current
2013-10-26	Mark Abraham	Encapsulate gmx_wallclock_accounting_t into new timing...	blob \| commitdiff \| raw \| diff to current
2013-10-26	Mark Abraham	Cleaned up run time measurement	blob \| commitdiff \| raw \| diff to current
2013-10-23	Mark Abraham	Merge branch release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2013-10-17	Mark Abraham	Move mdrun trajectory writing into wrapper function	blob \| commitdiff \| raw \| diff to current
2013-10-08	Mark Abraham	Remove some unused variables from MD loop	blob \| commitdiff \| raw \| diff to current
2013-09-26	Teemu Murtola	Merge "Merge branch release-4-6"	blob \| commitdiff \| raw \| diff to current
2013-09-26	Mark Abraham	Merge branch release-4-6	blob \| commitdiff \| raw \| diff to current
2013-09-26	Mark Abraham	Remove mdrun -ionize feature	blob \| commitdiff \| raw \| diff to current
2013-09-26	Mark Abraham	Remove General Coupling Theory stuff	blob \| commitdiff \| raw \| diff to current
2013-09-20	Mark Abraham	Merge branch 'release-4-6'	blob \| commitdiff \| raw \| diff to current
2013-09-20	Teemu Murtola	Merge branch 'release-4-6'	blob \| commitdiff \| raw \| diff to current
2013-09-18	Mark Abraham	Remove forcefield-scan feature	blob \| commitdiff \| raw \| diff to current
2013-07-26	Mark Abraham	Merge branch release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2013-07-25	Alexey Shvetsov	mdlib: clean up -Wunused-parameter warnings	blob \| commitdiff \| raw \| diff to current
2013-07-24	Roland Schulz	Merge "Merge branch release-4-6 into master"	blob \| commitdiff \| raw \| diff to current
2013-07-24	Mark Abraham	Merge branch release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2013-07-19	Teemu Murtola	Pre-emptively fix some C++ warnings.	blob \| commitdiff \| raw \| diff to current
2013-06-27	Roland Schulz	Merge branch 'release-4-6' into master	blob \| commitdiff \| raw \| diff to current
2013-06-27	Roland Schulz	Merge branch 'release-4-6' into master	blob \| commitdiff \| raw \| diff to current
2013-05-30	Mark Abraham	Merge "Merge branch 'release-4-6'"	blob \| commitdiff \| raw \| diff to current
2013-05-24	Teemu Murtola	Merge branch 'release-4-6'	blob \| commitdiff \| raw \| diff to current
2013-05-21	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2013-03-22	Roland Schulz	Fix problems with intel-mpi	blob \| commitdiff \| raw \| diff to current
2013-03-20	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2013-03-07	Teemu Murtola	Merge "Uncrustify template.cpp and selection.cpp."	blob \| commitdiff \| raw \| diff to current
2013-03-07	Teemu Murtola	Merge "Merge release-4-6 into master"	blob \| commitdiff \| raw \| diff to current
2013-02-26	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2013-02-26	Christoph Junghans	Merge "Merge release-4-6 into master"	blob \| commitdiff \| raw \| diff to current
2013-02-13	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2013-02-13	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2013-02-13	Roland Schulz	Code beautification with uncrustify	blob \| commitdiff \| raw \| diff to current
2013-01-21	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2013-01-20	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2013-01-15	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2012-12-20	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2012-12-12	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2012-12-03	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2012-11-25	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2012-11-19	Roland Schulz	Merge 'release-4-6' into master	blob \| commitdiff \| raw \| diff to current
2012-11-12	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2012-11-10	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2012-11-09	Roland Schulz	Merge origin/release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2012-11-03	Roland Schulz	Merge release-4-6 into master	blob \| commitdiff \| raw \| diff to current
2012-10-25	Roland Schulz	Merge remote-tracking branch 'origin/release-4-6' into...	blob \| commitdiff \| raw \| diff to current
2012-10-19	Roland Schulz	Merge branch 'release-4-6'	blob \| commitdiff \| raw \| diff to current
2012-10-17	Roland Schulz	Merge branch 'release-4-6'	blob \| commitdiff \| raw \| diff to current
2012-10-17	Roland Schulz	Merge branch 'release-4-6', adds the nbnxn functionality	blob \| commitdiff \| raw \| diff to current
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