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Tests for interactive selection input
2014-12-06
Teemu Murtola
Simplify analysisdata parallelism model
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2014-12-05
Teemu Murtola
Improve selection parsing error reporting
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2014-12-05
Teemu Murtola
Non-periodic nbsearch with grid based on bounding box
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2014-12-04
Teemu Murtola
Move/add uncrustify documentation to dev manual
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2014-12-02
Teemu Murtola
Add 'gmx pairdist' tool as partial g_mindist replacement
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2014-12-02
Teemu Murtola
Analysis grid nbsearch for more cases
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2014-11-29
Teemu Murtola
Basic support for 'z of ...' selections
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2014-11-28
Teemu Murtola
Clarify memory management for selection values
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2014-11-28
Teemu Murtola
Helper function for grouping selection positions
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2014-11-27
Teemu Murtola
Clean up gmx solvate
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2014-11-27
Teemu Murtola
Port gmx-solvate tests to use CommandLineTestBase
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2014-11-27
Teemu Murtola
More control over file backups
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2014-11-27
Teemu Murtola
Further insert-molecules cleanup
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2014-11-26
Teemu Murtola
Convert surface area calculation to C++
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2014-11-26
Teemu Murtola
Add some unit tests for surface area calculation
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2014-11-23
Teemu Murtola
Rename doc-* targets to be less generic
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2014-11-21
Teemu Murtola
Describe doc-check in developer manual
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2014-11-21
Teemu Murtola
Skeleton for a developer manual
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2014-11-14
Teemu Murtola
Refactor position-evaluated selection keyword handling
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2014-10-30
Teemu Murtola
Add more selection unit tests
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2014-10-30
Teemu Murtola
Fix more memory leaks in default group creation
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2014-10-30
Teemu Murtola
Fix memory leak in default index group creation
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2014-10-29
Teemu Murtola
Merge release-5-0 into master
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2014-10-29
Teemu Murtola
Improve analysis nbsearch grid mapping
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2014-10-28
Teemu Murtola
Avoid common.h inclusion in CUDA code
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2014-10-23
Teemu Murtola
Move truncate() wrapper to futil.h
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2014-10-23
Teemu Murtola
Encapsulate use of nice()
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2014-10-22
Teemu Murtola
Collect more platform-specific code to sysinfo.h
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2014-10-22
Teemu Murtola
Rename common.h to classhelpers.h
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2014-10-22
Teemu Murtola
Move basic macros from common.h to basedefinitions.h
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2014-10-14
Teemu Murtola
Check config.h usage in doc-check
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2014-10-14
Teemu Murtola
Use analysis nbsearch in insert-molecules
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2014-10-11
Teemu Murtola
Clean up gmx insert-molecules
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2014-10-11
Teemu Murtola
Make 'gmx insert-molecules' tests test output
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2014-10-11
Teemu Murtola
Generalize command-line unit testing machinery
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2014-10-03
Teemu Murtola
More robust handling for installed headers
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2014-09-23
Teemu Murtola
Reorganize CPack management
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2014-09-23
Teemu Murtola
Generate man pages and completions by default if possible
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2014-09-22
Teemu Murtola
Merge "Merge release-5-0 into master"
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2014-09-21
Teemu Murtola
Introduce a variable to identify in-source build
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2014-09-21
Teemu Murtola
Skip man/html/completion generation if not needed
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2014-09-20
Teemu Murtola
Remove duplication in version info target creation
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2014-09-20
Teemu Murtola
Fix patterns for .gitattributes
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2014-09-19
Teemu Murtola
Proper dependencies for Doxygen build rules
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2014-09-19
Teemu Murtola
Fix histogram resampling output bin positions
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2014-09-19
Teemu Murtola
Embed module dependency graph in Doxygen docs
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2014-09-19
Teemu Murtola
Add support for cumulative histograms
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2014-09-19
Teemu Murtola
More precise analysisdata histogram accumulation
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2014-09-19
Teemu Murtola
Misc. Doxygen build system improvements
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2014-09-13
Teemu Murtola
Extend support for float/double tolerances in testing
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2014-09-13
Teemu Murtola
Declare __STDC_*_MACROS in gmxpre.h
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2014-09-12
Teemu Murtola
Run include order check in doc-check
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2014-09-11
Teemu Murtola
Improve uncrustify.sh return code handling
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2014-09-11
Teemu Murtola
Include directive sorter
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2014-09-11
Teemu Murtola
Add gmx_getpid()
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2014-09-11
Teemu Murtola
Move _GNU_SOURCE to gmxpre.h
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2014-09-11
Teemu Murtola
Sort includes outside src/gromacs
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2014-09-11
Teemu Murtola
Sort all includes in src/gromacs
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2014-09-11
Teemu Murtola
Use absolute include paths in nbnxn kernels
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2014-09-11
Teemu Murtola
Manually sort some includes in src/gromacs
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2014-09-08
Teemu Murtola
Support custom default extension for FileNameOption
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2014-09-08
Teemu Murtola
Remove unnecessary extensions in t_filenm defaults
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2014-09-07
Teemu Murtola
More consistent default handling for StringOption
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2014-09-07
Teemu Murtola
Update template/README
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2014-09-05
Teemu Murtola
Remove unnecessary config.h includes
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2014-09-05
Teemu Murtola
Move some defines to gmxpre.h for thread-MPI
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2014-09-05
Teemu Murtola
Another batch of added config.h
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2014-09-05
Teemu Murtola
Make doc-check fail the build on warnings
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2014-09-05
Teemu Murtola
Merge "Merge release-5-0 into master"
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2014-09-04
Teemu Murtola
Include config.h directly if used
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2014-09-04
Teemu Murtola
Make doc-check silent for in-source build
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2014-09-04
Teemu Murtola
Merge "Merge release-5-0 into master"
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2014-08-24
Teemu Murtola
Precalculate pbc shift for analysis nbsearch
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2014-08-24
Teemu Murtola
Improve analysis nbsearch grid mapping
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2014-08-23
Teemu Murtola
Backport of 'Remove unused figures from share/html/'
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2014-08-22
Teemu Murtola
Move -nice handling to CommandLineModuleManager
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2014-08-20
Teemu Murtola
Misc. gmxpre.h-related changes
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2014-08-20
Teemu Murtola
Merge release-5-0 into master
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2014-08-20
Teemu Murtola
Remove unused config.h defines
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2014-08-19
Teemu Murtola
Introduce gmxpre.h for truly global definitions
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2014-08-16
Teemu Murtola
Disable analysisdata generic tests if not compilable
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2014-08-14
Teemu Murtola
Fix CMake package config after recent version changes
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2014-08-13
Teemu Murtola
Use native CMake mechanism for find_package(GROMACS)
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2014-08-13
Teemu Murtola
Reorganize CMake version information management
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2014-08-10
Teemu Murtola
Improve initAfterFirstFrame() usability
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2014-08-10
Teemu Murtola
Make vec.h const-correct with both C and C++
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2014-08-10
Teemu Murtola
Basic exclusion support for analysis nbsearch
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2014-08-09
Teemu Murtola
Add Selection::hasOnlyAtoms()
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2014-08-07
Teemu Murtola
Basic support for 2D neighborhood search for analysis
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2014-08-04
Teemu Murtola
Verify MD5 sum for FFTW download
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2014-08-03
Teemu Murtola
Check frame atom count before evaluating selections
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2014-07-31
Teemu Murtola
Merge "Merge release-5-0 into master"
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2014-07-24
Teemu Murtola
Do not actually install uniqueptr.h
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2014-07-16
Teemu Murtola
Fix HTML help and man pages for commands with dashes
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2014-07-12
Teemu Murtola
Make gmx_node_num/rank safer
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2014-07-11
Teemu Murtola
Fix HTML links that contain file extensions
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2014-07-10
Teemu Murtola
Bump SOVERSION
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2014-07-09
Teemu Murtola
Clean up gmx_header_config
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2014-07-09
Teemu Murtola
Merge release-5-0 into master
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2014-07-09
Teemu Murtola
Improve module dependency graph layout
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