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

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

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

2014-06-11	Erik Lindahl	Avoid writing xvgr formatting with -xvg none	blob \| commitdiff \| raw
2014-06-02	Berk Hess	Fixed g_energy Einstein viscosity	blob \| commitdiff \| raw \| diff to current
2014-01-09	David van der Spoel	Fixed precision in thermal expansion coefficient calc.	blob \| commitdiff \| raw \| diff to current
2013-04-19	Teemu Murtola	Merge branch 'release-4-5-patches'	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
2013-02-20	Mark Abraham	Merge release-4-5-patches into release-4-6	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 "Remove unnecessary ICC flags affecting performan...	blob \| commitdiff \| raw \| diff to current
2013-01-17	Mark Abraham	Merge "improved CUDA kernel performance by pre-loading...	blob \| commitdiff \| raw \| diff to current
2013-01-17	Christoph Junghans	Merge "Added note about make_edi and flooding in ED...	blob \| commitdiff \| raw \| diff to current
2013-01-17	Christoph Junghans	Merge "use the compiler version provided by CMake ...	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
2013-01-17	Christoph Junghans	Merge "note the reason for auto-disabling GPU support...	blob \| commitdiff \| raw \| diff to current
2013-01-17	Roland Schulz	Merge "clarify wording of GPU driver-related notes...	blob \| commitdiff \| raw \| diff to current
2013-01-17	Sander Pronk	Fixes to free energy code, output & g_bar compatibility.	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
2012-10-01	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	Szilard Pall	Merge branch 'release-4-5-patches' into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-08-20	Christoph Junghans	Merge "Fix coordinate is zero check in gmxcheck" into...	blob \| commitdiff \| raw \| diff to current
2012-08-16	David van der Spoel	Optional computation of fluct. props in g_energy. Fixes...	blob \| commitdiff \| raw \| diff to current
2012-07-13	Roland Schulz	Merge release-4.5-patches into HEAD	blob \| commitdiff \| raw \| diff to current
2012-06-04	Michael Shirts	Merging in free energy, exp. ensemble, & andersen t...	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
2012-05-07	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
2012-04-16	David van der Spoel	Merge "Added support for dssp2.X with the -ver option...	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
2012-04-03	Roland Schulz	Merge "Fixes problems with g_msd and g_energy" into...	blob \| commitdiff \| raw \| diff to current
2012-04-02	Michael Shirts	Fixes problems with g_msd and g_energy	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
2012-03-18	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
2011-09-16	Erik Lindahl	Merge "made allocation for LINCS with particle decompos...	blob \| commitdiff \| raw \| diff to current
2011-09-15	Berk Hess	Merge "Introduced different options for pdb2gmx termini...	blob \| commitdiff \| raw \| diff to current
2011-09-14	Mark Abraham	Format warning better	blob \| commitdiff \| raw \| diff to current
2011-09-13	Rossen Apostolov	Merge "Added warning line." into release-4-5-patches	blob \| commitdiff \| raw \| diff to current
2011-09-13	David van der Spoel	Added warning line.	blob \| commitdiff \| raw \| diff to current
2011-07-20	David van der Spoel	Merge branch 'release-4-5-patches' of git@git.gromacs...	blob \| commitdiff \| raw \| diff to current
2011-07-20	David van der Spoel	Added initialization of arrays after srenew call.	blob \| commitdiff \| raw \| diff to current
2011-07-01	David van der Spoel	Merge branch 'release-4-5-patches' of git@git.gromacs...	blob \| commitdiff \| raw \| diff to current
2011-06-10	David van der Spoel	Merge branch 'release-4-5-patches' of git@git.gromacs...	blob \| commitdiff \| raw \| diff to current
2011-06-08	Sander Pronk	Adressed over-eager warnings that gcc 4.5 generates.	blob \| commitdiff \| raw \| diff to current
2011-05-31	David van der Spoel	Further patches to fluctuation code and density of...	blob \| commitdiff \| raw \| diff to current
2011-05-23	David van der Spoel	Merge branch 'release-4-5-patches' of git@git.gromacs...	blob \| commitdiff \| raw \| diff to current
2011-05-23	David van der Spoel	Re-implemented the fluctuation analysis, based on Entha...	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
2011-04-04	David van der Spoel	Merge branch 'release-4-5-patches' into orderparm	blob \| commitdiff \| raw \| diff to current
2011-03-30	Justin Lemkul	Updated g_energy help information.	blob \| commitdiff \| raw \| diff to current
2011-03-23	Justin Lemkul	Tons of small fixes to documentation.	blob \| commitdiff \| raw \| diff to current
2011-02-10	Sander Pronk	Fixed a bug in g_energy -odh	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
2011-01-29	David van der Spoel	Merge branch 'release-4-5-patches' of git@git.gromacs...	blob \| commitdiff \| raw \| diff to current
2011-01-26	David van der Spoel	Merge branch 'release-4-5-patches' of git@git.gromacs...	blob \| commitdiff \| raw \| diff to current
2011-01-24	Justin Lemkul	Various small changes to the man pages.	blob \| commitdiff \| raw \| diff to current
2011-01-23	Mark Abraham	Improved consistency of text style usage	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
2010-12-25	David van der Spoel	Added warning in g_dipoles	blob \| commitdiff \| raw \| diff to current
2010-08-31	Sander Pronk	Fixed warning in gmx_energy	blob \| commitdiff \| raw \| diff to current
2010-08-30	Sander Pronk	Clearer error messages in g_energy.	blob \| commitdiff \| raw \| diff to current
2010-08-30	Sander Pronk	Fixed the g_energy -odh option to be less confusing.	blob \| commitdiff \| raw \| diff to current
2010-08-27	Erik Lindahl	Merge branch 'release-4-5-patches' of git.gromacs.org...	blob \| commitdiff \| raw \| diff to current
2010-08-27	Erik Lindahl	Fixed another uninitialized variable warning in gmx_ene...	blob \| commitdiff \| raw \| diff to current
2010-08-27	Erik Lindahl	Merge branch 'release-4-5-patches' of git.gromacs.org...	blob \| commitdiff \| raw \| diff to current
2010-08-27	Sander Pronk	Some documentation changes.	blob \| commitdiff \| raw \| diff to current
2010-08-26	Sander Pronk	gmx_bar now works with derivative histogram sets.	blob \| commitdiff \| raw \| diff to current
2010-08-26	Erik Lindahl	Merge branch 'release-4-5-patches' of git.gromacs.org...	blob \| commitdiff \| raw \| diff to current
2010-08-26	Sander Pronk	derivative histograms are now written in both positive...	blob \| commitdiff \| raw \| diff to current
2010-08-26	Sander Pronk	Free energy writing to ener.edr and four new options...	blob \| commitdiff \| raw \| diff to current
2010-08-25	Rossen Apostolov	Redefine the default boolean type to gmx_bool.	blob \| commitdiff \| raw \| diff to current
2010-08-23	Rossen Apostolov	Merge branch 'release-4-5-patches' of git.gromacs.org...	blob \| commitdiff \| raw \| diff to current
2010-08-22	Erik Lindahl	Replaced all occurences of str(n)casecmp with gmx_str...	blob \| commitdiff \| raw \| diff to current
2010-08-04	Erik Lindahl	Merge branch 'release-4-5-patches' of git.gromacs.org...	blob \| commitdiff \| raw \| diff to current
2010-08-04	Berk Hess	fixed g_energy manual formatting issues	blob \| commitdiff \| raw \| diff to current
2010-07-24	Sander Pronk	New .edr file format: now supports blocks of arbitrary...	blob \| commitdiff \| raw \| diff to current
2010-07-23	Berk Hess	fixed (rare) incorrect residue numbers when using gmx_m...	blob \| commitdiff \| raw \| diff to current
2010-06-20	Michael Shirts	Merge branch 'master' of git@git.gromacs.org:gromacs	blob \| commitdiff \| raw \| diff to current
2010-06-18	Gerrit Groenhof	Merge branch 'master' into qmmm	blob \| commitdiff \| raw \| diff to current
2010-06-17	Maarten Wolf	Merge branch 'master' of git@git.gromacs.org:gromacs	blob \| commitdiff \| raw \| diff to current
2010-06-17	Szilard Pall	Merge branch 'master' of git@git.gromacs.org:gromacs	blob \| commitdiff \| raw \| diff to current
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