| 2011-01-21 |
Justin Lemkul | More minor formatting/editorial fixes for the manual. |
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| 2011-01-04 |
ckutzne | Fixed inconvenient output file names if -sep is used... |
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| 2010-08-30 |
hess | Corrected trjconv check for topology presence, see... |
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| 2010-08-27 |
Erik Lindahl | Added trjconv check for topology prescence, see bugzill... |
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| 2010-08-25 |
Rossen Apostolov | Redefine the default boolean type to gmx_bool. |
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| 2010-08-17 |
Erik Lindahl | Merge branch 'release-4-5-patches' of git.gromacs.org... |
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| 2010-08-17 |
Michael Shirts | Merge branch 'release-4-5-patches' of git@git.gromacs... |
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| 2010-08-16 |
Berk Hess | gmx_rmpbc gets natoms passed again, without natoms... |
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| 2010-07-27 |
Erik Lindahl | Modified PDB io code to merely store the chain _identif... |
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| 2010-07-26 |
Erik Lindahl | Added lots of missing cmakedefines to config.h.cmakein |
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| 2010-07-26 |
Sander Pronk | Merge branch 'master' of git.gromacs.org:gromacs |
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| 2010-07-26 |
Sander Pronk | Added support for Windows _fseeki64. |
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| 2010-07-10 |
Michael Shirts | Fixed minor formatting conflict. |
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| 2010-07-05 |
Maarten Wolf | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2010-07-02 |
David van der Spoel | Merge branch 'master' of git.gromacs.org:gromacs |
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| 2010-07-02 |
David van der Spoel | Made removing pbc non-static. This affects many analysi... |
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| 2010-06-27 |
Michael Shirts | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2010-06-24 |
Szilard Pall | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2010-06-23 |
Gerrit Groenhof | Merge branch 'master' into qmmm |
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| 2010-06-22 |
Sander Pronk | Most (if not all) file operations are now thread safe. |
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| 2010-06-20 |
Michael Shirts | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2010-06-18 |
Gerrit Groenhof | Merge branch 'master' into qmmm |
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| 2010-06-17 |
Maarten Wolf | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2010-06-17 |
Szilard Pall | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2010-06-16 |
kasson | Merge branch 'mymaster' |
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| 2010-06-14 |
David van der Spoel | Merge branch 'master' of git.gromacs.org:gromacs |
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| 2010-06-14 |
David van der Spoel | Added more fixes in comment texts, generously provided... |
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| 2010-06-12 |
David van der Spoel | Fixed a lot of spelling errors in comments and document... |
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| 2010-06-09 |
Gerrit Groenhof | Merge branch 'master' into qmmm |
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| 2010-05-07 |
Szilard Pall | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2010-05-02 |
David van der Spoel | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2010-04-29 |
Berk Hess | Merge commit 'origin/master' into 2dpme |
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| 2010-04-29 |
Teemu Murtola | Fix for trjconv -e option (bug #305). |
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| 2010-04-27 |
Berk Hess | resolved merge conflicts |
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| 2010-03-12 |
David van der Spoel | Merge branch 'master' of git.gromacs.org:gromacs |
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| 2010-03-02 |
Roland Schulz | Merge branch 'release-4-0-patches' |
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| 2010-02-25 |
Roland Schulz | error message for -fit rot+trans -pbc |
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| 2010-02-25 |
Roland Schulz | error message for -fit rot+trans -pbc |
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| 2010-01-26 |
David van der Spoel | Merge branch 'master' of git.gromacs.org:gromacs |
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| 2010-01-25 |
Sander Pronk | Merge branch 'master' of git.gromacs.org:gromacs |
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| 2010-01-25 |
Sander Pronk | Fixed output_env member functions (names, support for... |
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| 2009-12-20 |
Michael Shirts | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2009-12-05 |
Michael Shirts | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2009-12-02 |
Berk Hess | Merge commit 'origin/master' into 2dpme |
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| 2009-12-01 |
David van der Spoel | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2009-11-30 |
Roland Schulz | close all files with ffclose which are opened with... |
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| 2009-11-30 |
David van der Spoel | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2009-11-27 |
Roland Schulz | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2009-11-27 |
Roland Schulz | More C++ fixes (const char), some formating |
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| 2009-11-27 |
Sander Pronk | More C++ fixes: #include "gmx_ana.h" was missing in all |
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| 2009-11-27 |
Michael Shirts | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2009-11-23 |
Roland Schulz | fixed md5 locking, removed misleading error message |
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| 2009-09-09 |
Michael Shirts | Merge branch 'master' of git://git.gromacs.org/gromacs |
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| 2009-08-30 |
kasson | Tool merge |
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| 2009-08-27 |
David van der Spoel | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2009-08-21 |
Sander Pronk | Added tests for isnan() and made trjconv C89 compatible. |
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| 2009-08-21 |
Sander Pronk | Merge branch 'thread_mpi'. Threads should work for... |
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| 2009-07-16 |
Peter Kasson | Merge branch 'master' of git@git.gromacs.org:gromacs |
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| 2009-07-16 |
kasson | PK added trjconv option to round time values to nearest ps. |
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| 2009-07-04 |
Sander Pronk | file names now const correct; builds in C++ |
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| 2009-06-30 |
Sander Pronk | added output_env_t type for querying time scales, and... |
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| 2009-06-04 |
Erik Lindahl | Removed Id tags from master branch since they will... |
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| 2009-06-03 |
lindahl | More fixes for warnings after enabling Gromacs compilat... |
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| 2009-06-03 |
teemu | Improved compilation (no errors, less warnings) of... |
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| 2009-04-10 |
spoel | Added support for writing CONECT records to pdb files... |
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| 2009-03-07 |
lindahl | Bugfixes to make gromacs compile in MS visual studio... |
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| 2009-03-06 |
hess | added t_resinfo struct to t_atoms which contains the... |
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| 2009-01-20 |
lindahl | Merged changes from 4.0.3 release into HEAD. |
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| 2009-01-18 |
lindahl | Fixed a ton of compiler warnings now generated with... |
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| 2008-10-30 |
hess | added option transxy for -fit |
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| 2008-10-30 |
hess | added option transxy for -fit |
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| 2008-10-09 |
hess | corrected conditions for inactive -ur warning |
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| 2008-10-09 |
hess | corrected conditions for inactive -ur warning |
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| 2008-08-15 |
hess | replaced efTRX for trajectory output by efTRO |
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| 2008-08-13 |
hess | fixed incorrect force output when index groups were... |
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| 2008-06-27 |
hess | added checkpoint to the file types that support velocities |
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| 2008-03-11 |
hess | implemented screw pbc |
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| 2008-03-07 |
hess | reorganized the pbc code, there is now an extra pbc_dx... |
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| 2008-02-02 |
hess | removed a array from t_block for cgs and mols, renamed... |
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| 2008-01-31 |
hess | fixed nan's with pbc=res without tpr |
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| 2007-12-19 |
spoel | Added option to prepend file numbers with zeroes when... |
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| 2007-12-04 |
spoel | Added option to translate everything |
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| 2007-11-27 |
hess | removed global variable stdlog |
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| 2007-10-16 |
spoel | Fixed bug 170 |
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| 2007-05-02 |
hess | added xy only translational and rotational fit |
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| 2006-09-14 |
hess | added option -boxcenter, fixed several bugs in the... |
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| 2006-09-02 |
spoel | Patched system calls |
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| 2006-08-30 |
spoel | Fixed compilation warnings and errors. |
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| 2006-07-19 |
spoel | Merges from 3.3 |
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| 2006-05-04 |
hess | split the -center option in -center and -boxcenter |
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| 2005-12-15 |
hess | fixed the (null) file names produced by -split |
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| 2005-12-08 |
lindahl | Merged in g96 velocities missing after conversion from... |
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| 2005-08-25 |
spoel | Removed compilation warnings |
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| 2005-08-22 |
hess | moved centering and pbc inbox to after fitting and... |
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| 2005-04-12 |
hess | added option for the definition of the center in calc_b... |
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| 2005-03-07 |
spoel | New (old) routines which will now be part of the gmx_an... |
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biod.pnpi.spb.ru / alexxy / gromacs.git / history