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Fixing copyright issues and code contributors
[alexxy/gromacs.git]
/
src
/
tools
/
gmx_msd.c
2013-01-18
Mark Abraham
Fixing copyright issues and code contributors
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2013-01-17
Mark Abraham
Merge branch 'release-4-5-patches' into release-4-6
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2013-01-11
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-11-29
Mark Abraham
Update copyright statements and change license to LGPL
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2012-11-26
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-11-23
Szilárd Páll
Merge "Updates to CMake treatment of OpenMP" into relea...
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2012-11-20
Christoph Junghans
Merge "Fix g_msd -mol" into release-4-6
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2012-11-20
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-11-10
Roland Schulz
Fix g_msd -mol
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2012-11-03
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-10-01
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-09-03
Szilard Pall
Merge branch 'release-4-5-patches' into release-4-6
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2012-07-13
Roland Schulz
Merge release-4.5-patches into HEAD
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2012-06-01
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-05-07
Teemu Murtola
Merge branch 'gerrit/release-4-5-patches' into release-4-6
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2012-04-29
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-04-29
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-04-26
Berk Hess
Merge release-4-5-patches into release-4-6
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2012-04-16
David van der Spoel
Merge "Added support for dssp2.X with the -ver option...
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2012-04-03
Roland Schulz
Merge remote-tracking branch 'gerrit/release-4-5-patche...
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2012-04-03
Roland Schulz
Merge "Fixes problems with g_msd and g_energy" into...
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2012-04-02
Michael Shirts
Fixes problems with g_msd and g_energy
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2012-03-28
Szilard Pall
Merge branch 'release-4-5-patches' into release-4-6
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2012-03-21
Roland Schulz
Removing unused code
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2011-01-30
David van der Spoel
Merge branch 'release-4-5-patches' into orderparm
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2011-01-26
David van der Spoel
Merge branch 'release-4-5-patches' of git@git.gromacs...
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2011-01-23
Mark Abraham
Improved consistency of text style usage
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2011-01-07
Mark Abraham
Added note that g_msd -mol does treat PBC (by making...
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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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2010-07-10
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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2010-06-09
Gerrit Groenhof
Merge branch 'master' into qmmm
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2010-06-03
Szilard Pall
Merge branch 'master' of git@git.gromacs.org:gromacs
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2010-06-02
Erik Marklund
Merge branch 'master' of git.gromacs.org:gromacs
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2010-06-02
David van der Spoel
Merge branch 'master' of git.gromacs.org:gromacs
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2010-06-02
David van der Spoel
Removed option CAN_DT from g_msd, since it cannot handl...
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2010-05-16
David van der Spoel
Merge branch 'master' of git.gromacs.org:gromacs
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2010-05-16
David van der Spoel
Merge branch 'master' of git@git.gromacs.org:gromacs
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2010-05-10
Sander Pronk
Cleaned up signal handling code.
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2010-04-27
Berk Hess
resolved merge conflicts
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2010-04-17
Peter Kasson
Merge branch 'master' of git@git.gromacs.org:gromacs
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2010-04-12
David van der Spoel
Merge branch 'master' of git@git.gromacs.org:gromacs
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2010-04-12
Sander Pronk
Fixed g_msd to print results with significant digits...
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2010-04-04
David van der Spoel
Merge branch 'master' of git.gromacs.org:gromacs
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2010-04-01
Sander Pronk
Changed/fixed g_msd to remove the center of mass motion...
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2010-03-02
Roland Schulz
Merge branch 'release-4-0-patches'
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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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2009-12-21
David van der Spoel
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-20
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-17
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-17
Berk Hess
fixed typos in the g_msd description
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2009-12-17
Berk Hess
Merge branch 'master' of git@git.gromacs.org:gromacs
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2009-12-17
Berk Hess
corrected the g_msd description
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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
a few more ffopen/ffclose fixes
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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
Sander Pronk
More C++ fixes: #include "gmx_ana.h" was missing in all
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2009-09-09
Michael Shirts
Merge branch 'master' of git://git.gromacs.org/gromacs
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2009-09-03
Berk Hess
Revert "PK added option to compute per-molecule msd...
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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
Merge branch 'thread_mpi'. Threads should work for...
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2009-07-06
Sander Pronk
more const-correctness fixes
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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
teemu
Fixed many warnings about const issues in C++.
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2009-06-03
lindahl
More fixes for warnings after enabling Gromacs compilat...
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2009-03-11
kasson
PK added option to compute per-molecule msd in g_msd
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2009-02-24
spoel
Adapted programs for using the gmx_statistics library
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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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2008-02-27
hess
fixed several bugs/issues with option -mol, added full...
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2008-02-02
hess
removed a array from t_block for cgs and mols, renamed...
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2007-06-07
spoel
Fixed bugzilla 151
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2006-10-17
hess
added a comm removal option
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2006-08-29
spoel
Merged in options from 3.3
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2006-05-17
spoel
Removed C++ style comments
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2006-04-18
hess
with -mol now determines the MSD for the center of...
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2005-05-09
hess
The diffusion constant is now by default fitted from...
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2005-04-03
spoel
Cosmetics
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2005-04-02
spoel
Fixed bug in -mol option
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2005-03-01
hess
changed the default for -trestart from 0 to 10, as...
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2004-12-14
hess
renamed all dummy/dummies to vsite/vsites in all filena...
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2004-09-06
spoel
Replaced the fatal_error routine by a more flexible...
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