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

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

[alexxy/gromacs.git] / src / mdlib / pme.c

2014-08-02	Berk Hess	Fixed PME bug with high OpenMP thread count	blob \| commitdiff \| raw
2014-06-14	Berk Hess	Fixed PME bug with #OpenMP-threads a large prime	blob \| commitdiff \| raw \| diff to current
2013-10-11	Berk Hess	introduced general 4-wide SIMD support	blob \| commitdiff \| raw \| diff to current
2013-09-20	Mark Abraham	Fix total time measurement with separate PME nodes	blob \| commitdiff \| raw \| diff to current
2013-07-24	Berk Hess	implemented plain-C SIMD macros for reference	blob \| commitdiff \| raw \| diff to current
2013-05-10	Sander Pronk	Merge "Fixing handling of perturbation mass changes...	blob \| commitdiff \| raw \| diff to current
2013-04-29	Mark Abraham	Merge "Update linking to MKL and document same" into...	blob \| commitdiff \| raw \| diff to current
2013-04-29	Mark Abraham	Merge "general SIMD acceleration for angles+dihedrals...	blob \| commitdiff \| raw \| diff to current
2013-04-29	Mark Abraham	Merge "PME load balancing now checks for PME grid restr...	blob \| commitdiff \| raw \| diff to current
2013-04-26	Mark Abraham	Merge "CUDA PME kernels with analytical Ewald correctio...	blob \| commitdiff \| raw \| diff to current
2013-04-26	Berk Hess	PME load balancing now checks for PME grid restrictions	blob \| commitdiff \| raw \| diff to current
2013-04-19	Teemu Murtola	Merge branch 'release-4-5-patches'	blob \| commitdiff \| raw \| diff to current
2013-04-16	David van der Spoel	Merge "corrected grompp rvdw charge-group radii check...	blob \| commitdiff \| raw \| diff to current
2013-04-13	David van der Spoel	Merge "added mdrun check for Verlet+perturbed atoms...	blob \| commitdiff \| raw \| diff to current
2013-04-12	Mark Abraham	Merge "removed x86 specifics from nbnxn SIMD kernels...	blob \| commitdiff \| raw \| diff to current
2013-04-12	Mark Abraham	Merge "corrected log file wall time breakdown" into...	blob \| commitdiff \| raw \| diff to current
2013-04-12	Mark Abraham	Merge "made PME work with a mix of 1 and more threads...	blob \| commitdiff \| raw \| diff to current
2013-03-26	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2013-03-21	Berk Hess	made PME work with a mix of 1 and more threads	blob \| commitdiff \| raw \| diff to current
2013-02-20	Mark Abraham	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2013-02-15	Mark Abraham	Merge "Unwinds flag dependencies in g_order." into...	blob \| commitdiff \| raw \| diff to current
2013-02-15	Mark Abraham	Merge "use legacy CUDA non-bonded kernels only on Fermi...	blob \| commitdiff \| raw \| diff to current
2013-02-13	Roland Schulz	Merge "improve setup of multiple tf tables" into releas...	blob \| commitdiff \| raw \| diff to current
2013-02-13	Roland Schulz	Merge "Updated FindGSL.cmake to version written by...	blob \| commitdiff \| raw \| diff to current
2013-02-12	Mark Abraham	Merge "PME-only counters are now reset with -maxh ...	blob \| commitdiff \| raw \| diff to current
2013-02-01	Berk Hess	PME-only counters are now reset with -maxh -resethway	blob \| commitdiff \| raw \| diff to current
2013-01-22	Mark Abraham	Merge "added missing cleanup of some nbnxn_cuda data...	blob \| commitdiff \| raw \| diff to current
2013-01-18	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2013-01-18	Roland Schulz	Code beautification with uncrustify	blob \| commitdiff \| raw \| diff to current
2013-01-18	Mark Abraham	Fixing copyright issues and code contributors	blob \| commitdiff \| raw \| diff to current
2013-01-17	Mark Abraham	Merge branch 'release-4-5-patches' into release-4-6	blob \| commitdiff \| raw \| diff to current
2013-01-11	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-11-29	Mark Abraham	Update copyright statements and change license to LGPL	blob \| commitdiff \| raw \| diff to current
2012-11-26	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-11-20	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-11-03	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-10-17	Kasson	Merge "Make Gromacs compile without C++ compiler" into...	blob \| commitdiff \| raw \| diff to current
2012-10-13	David van der Spoel	Merge "Fixing issues with replica exchange" into releas...	blob \| commitdiff \| raw \| diff to current
2012-10-12	Berk Hess	Merge "Fix illegal barrier in worksharing" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-10-12	Roland Schulz	Fix illegal barrier in worksharing	blob \| commitdiff \| raw \| diff to current
2012-10-02	Szilard Pall	added Verlet scheme and NxN non-bonded functionality	blob \| commitdiff \| raw \| diff to current
2012-10-01	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-09-24	Kasson	Merge "Fixed segfault with FE code for older tpr files...	blob \| commitdiff \| raw \| diff to current
2012-09-10	Roland Schulz	Merge "Update use of CPack components and add install...	blob \| commitdiff \| raw \| diff to current
2012-09-07	Christoph Junghans	Merge "Fix VMD plugins on Windows" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-09-04	Christoph Junghans	Merge "Fixes too many backup files for *.nroff files...	blob \| commitdiff \| raw \| diff to current
2012-09-03	Kasson	Merge "Document correct comm_mode option" into release...	blob \| commitdiff \| raw \| diff to current
2012-09-03	Kasson	Merge "Improved pdb2gmx output" into release-4-5-patches	blob \| commitdiff \| raw \| diff to current
2012-09-03	Szilard Pall	Merge branch 'release-4-5-patches' into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-08-29	Berk Hess	bug fix for pme.c MPI_COMM_NULL fix dcf8b67e	blob \| commitdiff \| raw \| diff to current
2012-07-25	Roland Schulz	Merge "fix a segfault in sse_mask_init" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-07-17	Berk Hess	fix a segfault in sse_mask_init	blob \| commitdiff \| raw \| diff to current
2012-07-13	Roland Schulz	Merge release-4.5-patches into HEAD	blob \| commitdiff \| raw \| diff to current
2012-07-05	Christoph Junghans	Merge "Don't rerun checks and be quiet 2nd time cmake...	blob \| commitdiff \| raw \| diff to current
2012-06-29	Sebastian Fritsch	Merge "Fixed adress kernel for double precision" into...	blob \| commitdiff \| raw \| diff to current
2012-06-28	Christoph Junghans	Merge "Fix MPI build for MPI library without mpi wrappe...	blob \| commitdiff \| raw \| diff to current
2012-06-27	Szilard Pall	fixes typo gmx_omp introduced by 697bcdc	blob \| commitdiff \| raw \| diff to current
2012-06-26	Roland Schulz	Merge "Fix gmx_fatal for serial compilation" into relea...	blob \| commitdiff \| raw \| diff to current
2012-06-25	Szilard Pall	introduce gmx_omp wrapper for the OpenMP API	blob \| commitdiff \| raw \| diff to current
2012-06-24	Michael Shirts	Merge "Fix mdp_opt formatting of expanded ensemble...	blob \| commitdiff \| raw \| diff to current
2012-06-22	Christoph Junghans	Merge "Simple patch for openmm_wrapper.cpp" into releas...	blob \| commitdiff \| raw \| diff to current
2012-06-16	Erik Lindahl	New CPU detection & AVX/SSE code, removed raw assembly...	blob \| commitdiff \| raw \| diff to current
2012-06-01	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-05-08	Roland Schulz	Fixing more Clang warnings	blob \| commitdiff \| raw \| diff to current
2012-05-07	Teemu Murtola	Merge branch 'gerrit/release-4-5-patches' into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-04-29	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-04-29	David van der Spoel	Merge "changed number of iatoms for F_SETTLE from 1...	blob \| commitdiff \| raw \| diff to current
2012-04-29	David van der Spoel	Merge "added support for graphs not starting at 0"...	blob \| commitdiff \| raw \| diff to current
2012-04-29	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-04-28	Berk Hess	fixed PME forces with FE, fixes #929 introduced in...	blob \| commitdiff \| raw \| diff to current
2012-04-28	Teemu Murtola	Merge "Fix for sigaction" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-04-28	Roland Schulz	Fix srenew/sfree_aligned misuse in PME	blob \| commitdiff \| raw \| diff to current
2012-04-28	Mark Abraham	Merge "Remove checks based on Generator" into release...	blob \| commitdiff \| raw \| diff to current
2012-04-28	Mark Abraham	Merge "Fix version info generation for autoconf." into...	blob \| commitdiff \| raw \| diff to current
2012-04-27	Berk Hess	fixed segv in TPI with PME, fixes #927	blob \| commitdiff \| raw \| diff to current
2012-04-27	Berk Hess	changed PME MPI_Comm comparisions to MPI_COMM_NULL...	blob \| commitdiff \| raw \| diff to current
2012-04-26	Berk Hess	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-04-25	Berk Hess	replaced PPPM by P3M-AD: a few lines in pme.c	blob \| commitdiff \| raw \| diff to current
2012-04-23	Christoph Junghans	Merge "compiler flag fixes" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-04-22	Roland Schulz	Resolving a couple of clang analyzer warnings	blob \| commitdiff \| raw \| diff to current
2012-04-03	Roland Schulz	Merge remote-tracking branch 'gerrit/release-4-5-patche...	blob \| commitdiff \| raw \| diff to current
2012-03-28	Szilard Pall	Merge branch 'release-4-5-patches' into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-03-21	Roland Schulz	Removing unused code	blob \| commitdiff \| raw \| diff to current
2012-03-20	Roland Schulz	Fix incorrect fclose usage	blob \| commitdiff \| raw \| diff to current
2012-03-16	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-02-29	Szilard Pall	Merge branch 'release-4-5-patches' into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-02-23	Roland Schulz	Merge remote-tracking branch 'gerrit/release-4-5-patche...	blob \| commitdiff \| raw \| diff to current
2012-02-09	Szilard Pall	renamed GMX_THREADS to GMX_THREAD_MPI	blob \| commitdiff \| raw \| diff to current
2012-02-08	Roland Schulz	Merge remote-tracking branch 'gerrit/release-4-5-patche...	blob \| commitdiff \| raw \| diff to current
2012-02-08	Christoph Junghans	Merge "fixed confusing nonbonded kernel pointer initial...	blob \| commitdiff \| raw \| diff to current
2012-02-03	Roland Schulz	Merge remote-tracking branch 'gerrit/release-4-5-patche...	blob \| commitdiff \| raw \| diff to current
2012-02-03	David van der Spoel	Merge "Improved the accuracy of the sd1 integrator...	blob \| commitdiff \| raw \| diff to current
2012-02-02	Szilárd Páll	Merge "Merges in threading branch as one squashed commi...	blob \| commitdiff \| raw \| diff to current
2012-02-02	Roland Schulz	Merges in threading branch as one squashed commit	blob \| commitdiff \| raw \| diff to current
2011-01-30	David van der Spoel	Merge branch 'release-4-5-patches' into orderparm	blob \| commitdiff \| raw \| diff to current
2010-12-26	David van der Spoel	Merge branch 'release-4-5-patches' of git@git.gromacs...	blob \| commitdiff \| raw \| diff to current
2010-12-21	Berk Hess	pme.c work-around for MPI fatal error in pme with partt...	blob \| commitdiff \| raw \| diff to current
2010-10-28	David van der Spoel	Merge branch 'release-4-5-patches' of git.gromacs.org...	blob \| commitdiff \| raw \| diff to current
2010-10-15	Berk Hess	more fixes for TPI with PME, now really fixed bugzilla 590	blob \| commitdiff \| raw \| diff to current
2010-10-09	Erik Lindahl	Merge branch 'release-4-5-patches' of git.gromacs.org...	blob \| commitdiff \| raw \| diff to current
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