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added Verlet scheme and NxN non-bonded functionality
[alexxy/gromacs.git]
/
src
/
tools
/
gmx_trjconv.c
2012-10-02
Szilard Pall
added Verlet scheme and NxN non-bonded functionality
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2012-10-01
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-09-24
Kasson
Merge "Fixed segfault with FE code for older tpr files...
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2012-09-10
Roland Schulz
Merge "Update use of CPack components and add install...
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2012-09-07
Christoph Junghans
Merge "Fix VMD plugins on Windows" into release-4-6
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2012-09-04
Christoph Junghans
Merge "Fixes too many backup files for *.nroff files...
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2012-09-03
Szilard Pall
Merge branch 'release-4-5-patches' into release-4-6
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2012-08-09
Berk Hess
fixed trjconv not writing velocities with cpt input
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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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2012-06-01
Christoph Junghans
Merge "Use External BLAS/LAPACK by default" into releas...
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2012-05-29
Christoph Junghans
Merge "Revised g_tune_pme" into release-4-6
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2012-05-27
David van der Spoel
Merge "added explicit sqrtf to the float version of...
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2012-05-25
David van der Spoel
Merge "grompp now retains the order of bonds converted...
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2012-05-25
Christoph Junghans
Merge "Fix that sigaction mask wasn't zeroed" into...
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2012-05-24
Teemu Murtola
Merge "Code cleanup to avoid name collisions" into...
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2012-05-23
Roland Schulz
Code cleanup to avoid name collisions
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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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2012-04-23
Christoph Junghans
Merge "compiler flag fixes" into release-4-6
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2012-04-22
Roland Schulz
Merge "enable command line option cheking in mdrun...
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2012-04-17
Mark Abraham
Added Windows-specific #defines, and use them
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2012-04-03
Roland Schulz
Merge remote-tracking branch 'gerrit/release-4-5-patche...
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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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2012-03-16
Roland Schulz
Merge release-4-5-patches into release-4-6
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2012-03-15
Roland Schulz
Fix most errors found by cppcheck
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2012-02-08
Christoph Junghans
Merge "fixed confusing nonbonded kernel pointer initial...
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2012-02-03
Roland Schulz
Merge remote-tracking branch 'gerrit/release-4-5-patche...
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2012-02-02
Szilárd Páll
Merge "Append all ICC Performance flags only to Release...
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2012-02-02
Teemu Murtola
Merge "Revert "Fix ICC on Windows Build"" into release...
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2012-02-01
David van der Spoel
Merge "Fixed error message to identify the correct...
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2012-02-01
David van der Spoel
Merge "Fixed trjconv -sub" into release-4-5-patches
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2012-02-01
Mark Abraham
Fixed trjconv -sub
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2011-12-08
Roland Schulz
Merge "Added an option to easily compile contrib progra...
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2011-11-30
Roland Schulz
Merge "Merge remote-tracking branch 'gerrit/release...
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2011-11-27
Roland Schulz
Merge remote-tracking branch 'gerrit/release-4-5-patche...
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2011-09-27
Rossen Apostolov
Merge "Removed CMake warning for recent OpenMPI version...
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2011-09-26
Mark Abraham
Dropped some hints in the documentation
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2011-09-16
Erik Lindahl
Merge "made allocation for LINCS with particle decompos...
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2011-09-15
Berk Hess
Merge "Introduced different options for pdb2gmx termini...
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2011-09-15
Mark Abraham
Fix trjconv -sub
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2011-09-15
Mark Abraham
Warning about trjconv -sub needing many files open
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2011-08-02
Berk Hess
made trjconv -novel work again, fixes #722
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2011-07-01
David van der Spoel
Merge branch 'release-4-5-patches' of git@git.gromacs...
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2011-06-29
Mark Abraham
Improved error message and documentation
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2011-05-23
David van der Spoel
Merge branch 'release-4-5-patches' of git@git.gromacs...
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2011-05-10
Erik Marklund
Merge branch 'release-4-5-patches' of git@git.gromacs...
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2011-05-09
Mark Abraham
Added hint about calling trjconv more than once
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2011-05-09
Mark Abraham
Spaced out paragraphs in trjconv help
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2011-05-05
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
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2011-04-04
David van der Spoel
Merge branch 'release-4-5-patches' into orderparm
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2011-03-05
David van der Spoel
Merge branch 'release-4-5-patches' of git@git.gromacs...
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2011-02-24
Berk Hess
pdb model numbers now start at 1
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2011-01-30
Erik Lindahl
Improved PBC handling for large molecules during cluste...
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2011-01-30
Erik Lindahl
Fixed the pbc cluster option of trjconv by switching...
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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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2011-01-21
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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