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Merge "Added fatal error for constraints + L-BFGS minimizer" into release-4-5-patches
2013-01-15 Christoph JunghansMerge "Added fatal error for constraints + L-BFGS minimizer...
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2012-11-20 Christoph JunghansMerge "Fixes bug in g_hbond that makes it produce fatal...
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2012-10-27 Christoph JunghansMerge "Fix large file support" into release-4-5-patches
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2012-09-27 Christoph JunghansMerge "Fixed an off-by-one error in atom counting in...
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2012-09-25 Christoph JunghansMerge "Fix REMD use of gmx_large_int_t for #steps variable...
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2012-09-14 Christoph JunghansMerge "fixed recent bug with grompp check for P-R P...
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2012-08-20 Christoph JunghansMerge "Fix coordinate is zero check in gmxcheck" into...
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2012-08-07 Christoph JunghansMerge "fixed incorrect TPI results with dynamic box...
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2012-08-06 Christoph JunghansMerge "Added comment in get_structure about which structures...
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2012-07-09 Christoph JunghansMerge "Fixed bug in sfactor.c that makes g_rdf -sq...
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2012-06-19 Christoph JunghansMerge "Quiet linker on BlueGene" into release-4-5-patches
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2012-06-18 Christoph JunghansMerge "Fix g_lie counting last frame twice" into release...
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2012-06-15 Christoph JunghansMerge "Work around failure of endianness testing on...
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2012-06-08 Christoph JunghansMerge "Added more suggested strategies to error message...
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2012-06-01 Christoph JunghansMerge "Replace our fftpack version with Numpy's version...
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2012-05-28 Christoph JunghansMerge "Continuing to fix threading on Cygwin" into...
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2012-04-09 Christoph JunghansMerge "Documentation and error message enhancements...
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2012-04-09 Christoph JunghansMerge "Consolidated documentation of .mdp restraint...
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2012-03-18 Christoph JunghansMerge "Warnings against equilibrating with P-R P-coupling...
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2012-03-15 Christoph JunghansMerge "Clarified wording of documentation" into release...
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2012-03-12 Christoph JunghansMerge "More editorial fixes to tool documentation"...
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2012-02-10 Christoph JunghansMerge "Fixed bug with COM motion removal on part of...
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2012-02-01 Christoph JunghansMerge "Fix signed/unsigned warnings" into release-4...
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2012-01-15 Christoph JunghansMerge "Added CMake Toolchain file for BlueGene/P" into...
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2012-01-04 Christoph JunghansMerge "Documented the function of g_cluster -cl -noav...
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2011-12-19 Christoph JunghansSet GMX_*_ASM true if GMX_ACCELERATION != auto
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2011-11-08 Christoph JunghansMerge "Fixed bug #830 (segv in do_dssp)" into release...
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2011-10-20 Christoph JunghansMerge "Fixes for GB kernel" into release-4-5-patches
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2011-07-01 Christoph Junghansdl lib was missing in libgmx.pc if GMX_DLOPEN is enabled
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2011-06-16 Christoph Junghanscmake: rename LIB to GMXLIB to avoid conflict with...
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2011-06-09 Christoph JunghansMerge branch 'release-4-5-patches' of git://git.gromacs...
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2011-06-09 Christoph JunghansAdded a comment where bPhobics comes from
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2011-06-08 Christoph Junghansremoved duplicated bPhobics function (thx to Francois...
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2011-06-08 Christoph Junghanscmake: remove selection/test* from gmxlib sources
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2011-03-03 Christoph Junghansfixed a typo in cmake pkg-config files
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2011-01-23 Christoph Junghanscmake: added GMX_XML to fully disable xml support
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2011-01-23 Christoph Junghanscmake: add support for external blas/lapack
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2010-12-10 Christoph JunghansFixed wrong path ordering in GMX.bash introduced in...
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2010-11-29 Christoph JunghansGMXRC.* - fixed bug #614
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2010-11-29 Christoph Junghansadded power6 flags from Markus Rampp
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2010-11-24 Christoph Junghansconfigure: build shared libs unless mpi enabled (bug...
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2010-10-08 Christoph JunghansCMake: another fortran fix
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2010-10-06 Christoph JunghansCMake: fortran fix
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2010-10-05 Christoph Junghanscmake: give openmm default suffixes
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2010-10-05 Christoph Junghanscmake: install-mdrun should not install pkg-config...
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2010-09-30 Christoph Junghansconfigure: added '--disable-la-files' option
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2010-09-17 Christoph Junghansconfigure: power6 and fortran can now be enabled at...
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2010-09-17 Christoph Junghansconfigure: fortran kernels can also be compiled with...
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2010-09-15 Christoph Junghansconfigure: added missing quotes
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2010-09-15 Christoph JunghansFixed synchronization counter update for pwr6 kernels
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2010-08-30 Christoph Junghansfixed Template.mak
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2010-08-30 Christoph Junghansfixed a typo in old libxdrf fortran wrapper
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2010-08-30 Christoph Junghansforcerec.c: added missing int
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2010-08-27 Christoph Junghansadded a missing include to sighandler.h
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2010-08-23 Christoph Junghansfixed 2 typos in headers
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2010-08-23 Christoph JunghansFixed threads flags in pc files for autotools
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2010-08-18 Christoph Junghanscmake: do not suffix scripts
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2010-08-18 Christoph Junghanscmake: add so version to libs
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2010-08-18 Christoph Junghanscmake: make demux.pl and xplor2gmx.pl being installed...
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2010-08-18 Christoph Junghansport lib suffixes to cmake
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2010-08-17 Christoph Junghansstore custom GMX defines in pkgconfig files for cmake
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2010-08-17 Christoph Junghansfixed some out of srcdir build issue with cmake and...
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2010-08-17 Christoph Junghansstore custom GMX defines in pkgconfig files for autotools
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2010-08-17 Christoph Junghanssplit libs in Template.mak
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2010-08-17 Christoph Junghansmake cmake install a CMakeLists.txt for the template...
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2010-08-02 Christoph Junghansmake GMXRC.{bash,csh,zsh} export PKG_CONFIG_PATH
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2010-08-02 Christoph Junghansfixed linking of inputrec.h
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2010-07-30 Christoph Junghanscmake: make GSL fully optional
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2010-07-30 Christoph Junghansmerged parts of the debian patch set
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2010-07-30 Christoph Junghansremoved old motif stuff from statutil.h
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2010-07-30 Christoph Junghansremove some deprecated headers, which are not used...
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2010-07-30 Christoph Junghansswitched to the right gsl define (HAVE_LIBGSL) in cmake...
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2010-07-30 Christoph Junghansadded right threads flag in cmake pkg-config files
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2010-07-29 Christoph Junghanscmake creates pc files now
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2010-07-29 Christoph Junghanstell aclocal about config dir
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2010-07-29 Christoph JunghansMerge branch 'master' of git://git.gromacs.org/gromacs
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2010-07-29 Christoph Junghansadded configure check for 'ln -s'
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2010-07-28 Christoph JunghansMerge branch 'master' of git://git.gromacs.org/gromacs
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2010-07-28 Christoph Junghansupdated template program to new header style and added...
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2010-07-28 Christoph Junghansadded small script to check for usability of headers
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2010-07-28 Christoph Junghansfixed rest of include typos in headers
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2010-07-28 Christoph Junghansfixed some include typos in headers
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2010-07-27 Christoph Junghansadded -no-undefined to LDFLAGS of all libs
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2010-07-27 Christoph Junghansmake --enable-power6 compile again (bug #475)
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2010-07-22 Christoph Junghansfixed some include typos in headers
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2010-02-26 Christoph JunghansInstall pkgconfig files for libraries (bug #370).
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2010-02-18 Christoph JunghansDep issues with libgmxpreprocess (#392, #395).
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The ultimate molecular dynamics simulation package