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Update copyright statements and change license to LGPL
[alexxy/gromacs.git]
/
src
/
tools
/
do_dssp.c
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
Roland Schulz
Merge "removed group non-boneded call with verlet schem...
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2012-11-23
Roland Schulz
Merge "improve FindGROMACS.cmake" into release-4-6
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2012-11-23
Roland Schulz
Force C++ linking of the gpu_utils
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2012-11-20
Roland Schulz
Merge release-4-5-patches into release-4-6
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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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2012-04-22
Roland Schulz
Merge "enable command line option cheking in mdrun...
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2012-04-16
Roland Schulz
Merge "changed default for nstxout, nstvout and nstlog...
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2012-04-16
Roland Schulz
Merge "checkpoint files now contain a double precision...
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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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2012-04-16
Erik Marklund
Added support for dssp2.X with the -ver option
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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 "Improved error message" into release-4-5-patches
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2012-02-01
Christoph Junghans
Merge "Fix signed/unsigned warnings" into release-4...
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2012-01-31
Roland Schulz
Fix signed/unsigned warnings
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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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2011-11-08
Christoph Junghans
Merge "Fixed bug #830 (segv in do_dssp)" into release...
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2011-10-31
Carsten Kutzner
Fixed bug #830 (segv in do_dssp)
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2011-06-10
David van der Spoel
Merge branch 'release-4-5-patches' of git@git.gromacs...
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2011-06-09
Christoph Junghans
Merge branch 'release-4-5-patches' of git://git.gromacs...
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2011-06-09
Christoph Junghans
Added a comment where bPhobics comes from
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2011-06-08
Christoph Junghans
removed duplicated bPhobics function (thx to Francois...
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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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2011-03-23
Justin Lemkul
Tons of small fixes to documentation.
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2011-03-22
Justin Lemkul
Lots of editorial fixes to descriptions, etc. to make...
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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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2011-01-25
Mark Abraham
Improved do_dssp -ssdump output
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2011-01-25
Mark Abraham
Improved do_dssp -sc output
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2011-01-23
Mark Abraham
Improved consistency of text style usage
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2010-08-25
Rossen Apostolov
Redefine the default boolean type to gmx_bool.
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2010-08-23
Rossen Apostolov
Merge branch 'release-4-5-patches' of git.gromacs.org...
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2010-08-22
Erik Lindahl
Fixed an unsigned/signed integer comparison
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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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2010-07-24
Sander Pronk
New .edr file format: now supports blocks of arbitrary...
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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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2010-06-10
Erik Marklund
Merge branch 'master' of git@git.gromacs.org:gromacs
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2010-06-09
Gerrit Groenhof
Merge branch 'master' into qmmm
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2010-06-08
Per Larsson
Merge branch 'master' of git.gromacs.org:gromacs
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2010-06-08
Rossen Apostolov
Merge branch 'master' of git.gromacs.org:gromacs
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2010-06-08
Rossen Apostolov
Added missing C-terminal oxygens OC1 and OC2 to the...
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2010-04-27
Berk Hess
resolved merge conflicts
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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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2009-12-20
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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2009-09-09
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
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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2009-06-23
Carsten Kutzner
Fixed check_oo memory corruption problem
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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
Restored C++ "fixes" that caused warnings for C.
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2009-06-03
lindahl
Fixed warnings when GNU C++ 4.3 is used.
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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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2009-04-29
carsten
Fixed several bugs when using do_dssp on proteins with...
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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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2008-03-11
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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2007-12-23
spoel
Removed traces of real dssp
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2007-12-19
spoel
Made processing of tmp files possible in /tmp
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2007-02-03
spoel
Added missing conditional fo printing xvgr codes
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