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

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

[alexxy/gromacs.git] / src / tools / gmx_tune_pme.c

2014-03-14	Carsten Kutzner	The van der Waals radius must equal the Coulomb radius...	blob \| commitdiff \| raw
2013-09-20	Mark Abraham	Described another way g_tune_pme might reasonably fail	blob \| commitdiff \| raw \| diff to current
2013-09-19	Mark Abraham	Fixed g_tune_pme assumption that MPI is available	blob \| commitdiff \| raw \| diff to current
2013-06-26	Carsten Kutzner	Fixed -npstring command line argument in g_tune_pme	blob \| commitdiff \| raw \| diff to current
2013-04-19	Teemu Murtola	Merge branch 'release-4-5-patches'	blob \| commitdiff \| raw \| diff to current
2013-04-13	David van der Spoel	Merge "added mdrun check for Verlet+perturbed atoms...	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
2013-03-06	Roland Schulz	Merge "fixed PME time print with -ntomp_pme != -ntomp...	blob \| commitdiff \| raw \| diff to current
2013-03-02	Christoph Junghans	Merge "Uncrustified code changes since 4.6" into releas...	blob \| commitdiff \| raw \| diff to current
2013-02-26	Mark Abraham	Uncrustified code changes since 4.6	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
2013-02-18	Carsten Kutzner	Made g_tune_pme work with 4.6 if user sets "-p" command...	blob \| commitdiff \| raw \| diff to current
2013-02-15	Mark Abraham	Merge "Re-generated group kernels" 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
2013-02-15	Mark Abraham	Merge "More descriptive Verlet kernel macro parameter...	blob \| commitdiff \| raw \| diff to current
2013-02-15	Mark Abraham	Merge "Fix and add Verlet kernel error messages" into...	blob \| commitdiff \| raw \| diff to current
2013-02-13	Sander Pronk	Merge "Fix code bug with thread-MPI on PowerPC with...	blob \| commitdiff \| raw \| diff to current
2013-02-13	Roland Schulz	Merge "Fixed the MPI recognition string in g_tune_pme...	blob \| commitdiff \| raw \| diff to current
2013-02-13	Carsten Kutzner	Fixed the MPI recognition string in g_tune_pme	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
2013-01-16	Carsten Kutzner	Made g_tune_pme work correctly again with thread-MPI...	blob \| commitdiff \| raw \| diff to current
2013-01-15	Sander Pronk	Merge "Continuation of documentation for expanded ensem...	blob \| commitdiff \| raw \| diff to current
2013-01-14	Carsten Kutzner	Essential dynamics output file now in .xvg format	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
2013-01-07	Roland Schulz	Merge "Print out atom numbers in g_rmsf" into release...	blob \| commitdiff \| raw \| diff to current
2013-01-07	Roland Schulz	Merge "Essential dynamics: fixed restarts when ED group...	blob \| commitdiff \| raw \| diff to current
2012-12-20	Erik Lindahl	Merge "cmake: added option to disable quotes" into...	blob \| commitdiff \| raw \| diff to current
2012-12-20	Erik Lindahl	Merge "Small fix for g_tune_pme" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-12-20	Carsten Kutzner	Small fix for g_tune_pme	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
2012-11-23	Szilárd Páll	Merge "Updates to CMake treatment of OpenMP" into relea...	blob \| commitdiff \| raw \| diff to current
2012-11-20	Christoph Junghans	Merge "Fix g_msd -mol" 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
2012-11-06	Berk Hess	Merge "Add option to install libcudart" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-11-06	Berk Hess	Merge "don't execute any mpi_info/mpiname in the path...	blob \| commitdiff \| raw \| diff to current
2012-11-06	Carsten Kutzner	Made g_tune_pme work correctly when ir->init_step > 0	blob \| commitdiff \| raw \| diff to current
2012-11-05	Berk Hess	Merge "updated several things related with OpenMP threa...	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
2012-10-18	Roland Schulz	Merge "Added thread affinity API to thread_mpi." into...	blob \| commitdiff \| raw \| diff to current
2012-10-17	Kasson	Merge "Make Gromacs compile without C++ compiler" into...	blob \| commitdiff \| raw \| diff to current
2012-10-16	Roland Schulz	Merge "made pair-search with GPU 20% faster" into relea...	blob \| commitdiff \| raw \| diff to current
2012-10-16	Carsten Kutzner	Made g_tune_pme read (ns/day) from 4.6 md.log output...	blob \| commitdiff \| raw \| diff to current
2012-10-16	Carsten Kutzner	Removed obsolete hint in error message.	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
2012-09-03	Szilard Pall	Merge branch 'release-4-5-patches' into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-07-13	Roland Schulz	Merge release-4.5-patches into HEAD	blob \| commitdiff \| raw \| diff to current
2012-06-15	Christoph Junghans	Merge "Work around failure of endianness testing on...	blob \| commitdiff \| raw \| diff to current
2012-06-14	Roland Schulz	Merge "Made mdrun more verbose about PME split" into...	blob \| commitdiff \| raw \| diff to current
2012-06-11	Carsten Kutzner	Small fix for g_tune_pme	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
2012-06-01	Christoph Junghans	Merge "Use External BLAS/LAPACK by default" into releas...	blob \| commitdiff \| raw \| diff to current
2012-05-29	Christoph Junghans	Merge "Revised g_tune_pme" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-05-23	Carsten Kutzner	Revised g_tune_pme	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	Roland Schulz	Merge release-4-5-patches into release-4-6	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
2012-04-03	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
2012-03-20	Roland Schulz	Fix incorrect fclose usage	blob \| commitdiff \| raw \| diff to current
2012-03-18	David van der Spoel	Merge "Fix typo in Clang CFlags" into release-4-5-patches	blob \| commitdiff \| raw \| diff to current
2012-03-18	David van der Spoel	Merge "Merge release-4-5-patches into release-4-6"...	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
2012-03-12	Christoph Junghans	Merge "More editorial fixes to tool documentation"...	blob \| commitdiff \| raw \| diff to current
2012-03-12	Teemu Murtola	Merge "Made description string for g_select -select...	blob \| commitdiff \| raw \| diff to current
2012-03-09	David van der Spoel	Merge "Improved cryptic error message" into release...	blob \| commitdiff \| raw \| diff to current
2012-03-09	Carsten Kutzner	Merge "Improved warning note with DD and periodic molec...	blob \| commitdiff \| raw \| diff to current
2012-03-09	Mark Abraham	More editorial fixes to tool documentation	blob \| commitdiff \| raw \| diff to current
2012-03-09	Mark Abraham	Editorial changes to tools documentation	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
2012-02-08	Roland Schulz	Merge remote-tracking branch 'gerrit/release-4-5-patche...	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
2012-01-19	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-01-15	Christoph Junghans	Merge "Added CMake Toolchain file for BlueGene/P" into...	blob \| commitdiff \| raw \| diff to current
2012-01-13	Roland Schulz	Merge "Fixed MSVC compiling with plug-in support" into...	blob \| commitdiff \| raw \| diff to current
2012-01-10	Christoph Junghans	Adds AdResS feature to gromacs	blob \| commitdiff \| raw \| diff to current
2012-01-04	Christoph Junghans	Merge "Documented the function of g_cluster -cl -noav...	blob \| commitdiff \| raw \| diff to current
2011-12-27	Roland Schulz	Merge "Added -dhdl to tpr file list, fixes #855" into...	blob \| commitdiff \| raw \| diff to current
2011-12-26	Roland Schulz	Merge remote-tracking branch 'gerrit/release-4-5-patche...	blob \| commitdiff \| raw \| diff to current
2011-12-20	Carsten Kutzner	Added -dhdl to tpr file list, fixes #855	blob \| commitdiff \| raw \| diff to current
2011-12-20	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2011-12-19	Carsten Kutzner	Enforced rotation	blob \| commitdiff \| raw \| diff to current
2011-12-08	Roland Schulz	Merge "Added an option to easily compile contrib progra...	blob \| commitdiff \| raw \| diff to current
2011-11-30	Roland Schulz	Merge "Merge remote-tracking branch 'gerrit/release...	blob \| commitdiff \| raw \| diff to current
2011-11-27	Roland Schulz	Merge remote-tracking branch 'gerrit/release-4-5-patche...	blob \| commitdiff \| raw \| diff to current
2011-11-24	Roland Schulz	Merge "Fixed g_angle -f -or to copy times from -f to...	blob \| commitdiff \| raw \| diff to current
2011-11-22	Carsten Kutzner	Actually -cpi and -bcpo must not be identical	blob \| commitdiff \| raw \| diff to current
2011-09-19	Justin A. Lemkul	Fixed typos in documentation.	blob \| commitdiff \| raw \| diff to current
2011-07-29	Carsten Kutzner	Fixed calculation of max and min number of PME-only...	blob \| commitdiff \| raw \| diff to current
2011-05-06	David van der Spoel	Merge branch 'release-4-5-patches' of git@git.gromacs...	blob \| commitdiff \| raw \| diff to current
2011-05-05	Erik Lindahl	Merge branch 'release-4-5-patches' of git.gromacs.org...	blob \| commitdiff \| raw \| diff to current
2011-04-10	David van der Spoel	Merge branch 'release-4-5-patches' of git.gromacs.org...	blob \| commitdiff \| raw \| diff to current
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