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Fixed minor issue with NPT conserved energy
[alexxy/gromacs.git]
/
src
/
gromacs
/
commandline
/
2014-10-05
Roland Schulz
Allow runAsMainSingleModule to be called more than...
tree
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commitdiff
2014-10-03
Teemu Murtola
More robust handling for installed headers
tree
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commitdiff
2014-10-01
Mark Abraham
Merge release-5-0 into master
tree
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commitdiff
2014-09-29
Roland Schulz
Merge release-4-6 into release-5-0
tree
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commitdiff
2014-09-21
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-09-18
Mark Abraham
Merge branch release-4-6 into release-5-0
tree
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commitdiff
2014-09-17
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-09-17
David van der Spoel
Merge release-5-0 into master
tree
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commitdiff
2014-09-11
Teemu Murtola
Sort all includes in src/gromacs
tree
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commitdiff
2014-09-10
David van der Spoel
Remove .tpa, .tpb, .tpx, .trj files. Part of #1500.
tree
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commitdiff
2014-09-10
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-09-08
Teemu Murtola
Support custom default extension for FileNameOption
tree
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commitdiff
2014-09-05
Teemu Murtola
Remove unnecessary config.h includes
tree
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commitdiff
2014-09-05
Teemu Murtola
Merge "Merge release-5-0 into master"
tree
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commitdiff
2014-09-05
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-09-04
Teemu Murtola
Include config.h directly if used
tree
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commitdiff
2014-09-04
Teemu Murtola
Merge "Merge release-5-0 into master"
tree
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commitdiff
2014-09-03
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-09-03
Roland Schulz
Fix MingW build
tree
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commitdiff
2014-09-01
Mark Abraham
Merge "Merge branch release-4-6 into release-5-0" into...
tree
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commitdiff
2014-09-01
Mark Abraham
Fixes and updates to BlueGene/Q support
tree
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commitdiff
2014-09-01
Mark Abraham
Merge branch release-4-6 into release-5-0
tree
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commitdiff
2014-08-29
Mark Abraham
Merge branch release-4-6 into release-5-0
tree
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commitdiff
2014-08-25
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-08-22
Teemu Murtola
Move -nice handling to CommandLineModuleManager
tree
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commitdiff
2014-08-20
Teemu Murtola
Merge release-5-0 into master
tree
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commitdiff
2014-08-19
Teemu Murtola
Introduce gmxpre.h for truly global definitions
tree
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commitdiff
2014-08-16
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-08-10
Roland Schulz
Merge release-4-6 into release-5-0
tree
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commitdiff
2014-08-07
Erik Lindahl
Fix portability issue with ArrayRef initializer overloading
tree
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commitdiff
2014-07-31
Teemu Murtola
Merge "Merge release-5-0 into master"
tree
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commitdiff
2014-07-31
Roland Schulz
Replace most strdup with gmx_strdup
tree
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commitdiff
2014-07-31
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-07-28
Roland Schulz
Merge "Merge release-5-0 into master"
tree
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commitdiff
2014-07-28
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-07-16
Teemu Murtola
Fix HTML help and man pages for commands with dashes
tree
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commitdiff
2014-07-12
Teemu Murtola
Make gmx_node_num/rank safer
tree
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commitdiff
2014-07-11
Teemu Murtola
Fix HTML links that contain file extensions
tree
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commitdiff
2014-07-09
Teemu Murtola
Merge release-5-0 into master
tree
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commitdiff
2014-07-09
Roland Schulz
Remove all unnecessary HAVE_CONFIG_H
tree
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commitdiff
2014-07-08
Teemu Murtola
Remove PCA_QUIET
tree
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commitdiff
2014-07-08
Teemu Murtola
Improve FileNameOption error handling
tree
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commitdiff
2014-07-08
Teemu Murtola
Remove selection help from SelectionCollection
tree
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commitdiff
2014-07-08
Teemu Murtola
Change some gmx_unique_ptr to shared_ptr in public...
tree
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commitdiff
2014-07-08
Teemu Murtola
Move -debug to cmdlinemodulemanager.cpp
tree
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commitdiff
2014-07-05
Teemu Murtola
Merge release-5-0 into master
tree
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commitdiff
2014-06-30
Teemu Murtola
Merge release-5-0 into master
tree
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commitdiff
2014-06-29
Roland Schulz
Merge release-4-6 into release-5-0
tree
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commitdiff
2014-06-28
Mark Abraham
Merge branch 'release-4-6' into release-5-0
tree
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commitdiff
2014-06-28
Roland Schulz
Merge release-5-0 into master
tree
|
commitdiff
2014-06-27
Roland Schulz
Merge release-4-6 into release-5-0
tree
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commitdiff
2014-06-26
Roland Schulz
Merge release-4-6 into release-5-0
tree
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commitdiff
2014-06-19
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-06-18
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-06-11
David van der Spoel
Fixes bug where -e and -dt flags did not work anymore.
tree
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commitdiff
2014-06-07
David van der Spoel
Merge "Merge release-5-0 into master"
tree
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commitdiff
2014-06-07
David van der Spoel
Merge release-5-0 into master
tree
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commitdiff
2014-06-07
Teemu Murtola
Improve (Selection|FileName)OptionManager handling
tree
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commitdiff
2014-06-07
Teemu Murtola
Replace all command line parsing with Options
tree
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commitdiff
2014-06-06
Mark Abraham
Merge release-4-6 into release-5-0
tree
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commitdiff
2014-06-03
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-05-27
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-05-27
Roland Schulz
Merge release-4-6 into release-5-0
tree
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commitdiff
2014-05-17
Teemu Murtola
Unit tests for parse_common_args() file options
tree
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commitdiff
2014-05-10
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-05-10
Roland Schulz
Merge release-4-6 into release-5-0
tree
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commitdiff
2014-04-29
Mark Abraham
Merge branch release-4-6 into release-5-0
tree
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commitdiff
2014-04-27
Teemu Murtola
Move rvec and friends to math/vectypes.h
tree
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commitdiff
2014-04-27
Teemu Murtola
Move 'real' definition to utility/real.h
tree
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commitdiff
2014-04-16
Roland Schulz
Merge release-5-0 into master
tree
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commitdiff
2014-04-13
Teemu Murtola
Remove utility -> fileio dependencies
tree
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commitdiff
2014-04-10
Mark Abraham
Merge branch 'release-4-6' into release-5-0
tree
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commitdiff
2014-04-10
Teemu Murtola
Remove utility/ dependencies on network.h and main.h
tree
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commitdiff
2014-04-08
Teemu Murtola
Move gmx_fatal.* to utility/fatalerror.*
tree
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commitdiff
2014-04-04
Teemu Murtola
Remove ancient SGI-specific code
tree
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commitdiff
2014-04-02
Teemu Murtola
Move string2.* to utility/cstringutil.*
tree
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commitdiff
2014-04-01
Teemu Murtola
Move smalloc.h to utility/
tree
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commitdiff
2014-03-31
Teemu Murtola
Remove dependency on commandline/ from oenv.cpp
tree
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commitdiff
2014-03-29
Teemu Murtola
Optimize intermodule dependencies
tree
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commitdiff
2014-03-29
Teemu Murtola
Improve version information handling
tree
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commitdiff
2014-03-27
Teemu Murtola
Misc. Doxygen fixes
tree
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commitdiff
2014-03-27
Teemu Murtola
Move thread_mpi to src/external/
tree
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commitdiff
2014-03-23
Mark Abraham
Merge branch release-4-6
tree
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commitdiff
2014-03-17
Rossen Apostolov
Cleaned up endif/else-s in CMakeLists.txt and *.cmake...
tree
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commitdiff
2014-03-17
Mark Abraham
Merge branch release-4-6
tree
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commitdiff
2014-03-11
Teemu Murtola
Fix misc. Doxygen issues
tree
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commitdiff
2014-03-03
Roland Schulz
Merge release-4-6 into master
tree
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commitdiff
2014-03-01
Teemu Murtola
Move default library path search to program context
tree
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commitdiff
2014-02-25
Mark Abraham
Keep compilers happy on BG/Q
tree
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commitdiff
2014-02-21
Roland Schulz
Merge release-4-6 into master
tree
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commitdiff
2014-02-16
Mark Abraham
Fix test reference data accidentally broken
tree
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commitdiff
2014-02-16
Mark Abraham
Remove support for .g87 and .xyz I/O formats
tree
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commitdiff
2014-02-16
Teemu Murtola
Improve man page formatting slightly
tree
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commitdiff
2014-02-16
Teemu Murtola
Fix default enum values in help output
tree
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commitdiff
2014-02-09
Teemu Murtola
Shell completions through Options
tree
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commitdiff
2014-02-09
Teemu Murtola
Make 'gmx -h' invariant wrt. provided options
tree
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commitdiff
2014-02-09
Teemu Murtola
Remove old help formatting code
tree
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commitdiff
2014-02-09
Teemu Murtola
Make FileNameOption behave more like old filenm parser
tree
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commitdiff
2014-02-09
Teemu Murtola
Implement synopsis for help output
tree
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commitdiff
2014-02-09
Teemu Murtola
Refactor new help formatting implementation
tree
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commitdiff
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