BioD PNPI Git Repos - alexxy/gromacs.git/search

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2013-04-25	David van der Spoel	Updated source for Van der Waals radii.	commit \| commitdiff \| tree
2013-04-17	Teemu Murtola	Add check for empty selections.	commit \| commitdiff \| tree
2013-04-17	Teemu Murtola	Implement remaining SelectionOption flags.	commit \| commitdiff \| tree
2013-04-12	David van der Spoel	Merge "Add histogram output for 'gmx gangle'."	commit \| commitdiff \| tree
2013-03-22	Roland Schulz	Fix problems with intel-mpi	commit \| commitdiff \| tree
2013-03-22	Teemu Murtola	Merge "Merge release-4-6 into master"	commit \| commitdiff \| tree
2013-03-07	Teemu Murtola	Merge "Uncrustify template.cpp and selection.cpp."	commit \| commitdiff \| tree
2013-03-07	Teemu Murtola	Merge "Merge release-4-6 into master"	commit \| commitdiff \| tree
2013-03-06	Roland Schulz	Merge "fixed PME time print with -ntomp_pme != -ntomp...	commit \| commitdiff \| tree
2013-03-05	Mark Abraham	New patch release 4.6.1	commit \| commitdiff \| tree
2013-03-05	Mark Abraham	Fix automated regression testing GMXLIB value	commit \| commitdiff \| tree
2013-03-05	Berk Hess	fixed bug with DD cut-off check and PME DLB	commit \| commitdiff \| tree
2013-03-05	Mark Abraham	Fix regressiontests automated download	commit \| commitdiff \| tree
2013-03-05	Berk Hess	fixed recent bug with sorting atoms for GPUs	commit \| commitdiff \| tree
2013-03-05	Mark Abraham	Update shell completions	commit \| commitdiff \| tree
2013-03-05	Mark Abraham	Update outdated admin things	commit \| commitdiff \| tree
2013-03-05	Justin Lemkul	Fixes for install guide page.	commit \| commitdiff \| tree
2013-03-05	Mark Abraham	Updated install guide	commit \| commitdiff \| tree
2013-03-02	Christoph Junghans	Merge "Uncrustified code changes since 4.6" into release-4-6	commit \| commitdiff \| tree
2013-02-26	Christoph Junghans	Merge "Merge release-4-6 into master"	commit \| commitdiff \| tree
2013-02-20	Christoph Junghans	Bump shared object version to 8	commit \| commitdiff \| tree
2013-02-20	Berk Hess	fixed issues with FEP soft-core and cut-off's	commit \| commitdiff \| tree
2013-02-18	Berk Hess	fixed GPU particle gridding performance issue	commit \| commitdiff \| tree
2013-02-18	Carsten Kutzner	Made g_tune_pme work with 4.6 if user sets "-p" command...	commit \| commitdiff \| tree
2013-02-18	Mark Abraham	Fix CMake namespace pollution	commit \| commitdiff \| tree
2013-02-16	Roland Schulz	Add missing include	commit \| commitdiff \| tree
2013-02-15	Mark Abraham	Merge "Minor fixes to Verlet kernels" into release-4-6	commit \| commitdiff \| tree
2013-02-15	Mark Abraham	Merge "improved PME load balancing reporting" into...	commit \| commitdiff \| tree
2013-02-15	Mark Abraham	Merge "Re-generated group kernels" into release-4-6	commit \| commitdiff \| tree
2013-02-15	Mark Abraham	Merge "Unwinds flag dependencies in g_order." into...	commit \| commitdiff \| tree
2013-02-15	David van der Spoel	Merge "Fixed an initialization issue in gmx_dipoles...	commit \| commitdiff \| tree
2013-02-15	Mark Abraham	Merge "use legacy CUDA non-bonded kernels only on Fermi...	commit \| commitdiff \| tree
2013-02-15	Mark Abraham	Merge "More descriptive Verlet kernel macro parameter...	commit \| commitdiff \| tree
2013-02-15	Berk Hess	improved PME load balancing reporting	commit \| commitdiff \| tree
2013-02-15	Mark Abraham	Minor fixes to Verlet kernels	commit \| commitdiff \| tree
2013-02-15	Mark Abraham	Merge "Fix and add Verlet kernel error messages" into...	commit \| commitdiff \| tree
2013-02-13	Teemu Murtola	Fix velocity and force evaluation for empty selections.	commit \| commitdiff \| tree
2013-02-13	Teemu Murtola	Change ConstArrayRef constructor argument order.	commit \| commitdiff \| tree
2013-02-13	Teemu Murtola	Add continuous array accessors for selection data.	commit \| commitdiff \| tree
2013-02-13	Teemu Murtola	Add tests for selection mass evaluation and fix it.	commit \| commitdiff \| tree
2013-02-13	Sander Pronk	Merge "Fix code bug with thread-MPI on PowerPC with...	commit \| commitdiff \| tree
2013-02-13	Roland Schulz	Merge "Fixed the MPI recognition string in g_tune_pme...	commit \| commitdiff \| tree
2013-02-13	Roland Schulz	Merge "improve setup of multiple tf tables" into release-4-6	commit \| commitdiff \| tree
2013-02-13	Roland Schulz	Merge "Updated FindGSL.cmake to version written by...	commit \| commitdiff \| tree
2013-02-12	Mark Abraham	Merge "PME-only counters are now reset with -maxh ...	commit \| commitdiff \| tree
2013-02-12	Christoph Junghans	Updated FindGSL.cmake to version written by me.	commit \| commitdiff \| tree
2013-02-12	Mark Abraham	Merge "fixed bug with sd integrator and OpenMP threading...	commit \| commitdiff \| tree
2013-02-12	Mark Abraham	Merge "Fix CUDA_HOST_COMPILER flag name" into release-4-6	commit \| commitdiff \| tree
2013-02-12	Mark Abraham	Merge "Remove duplicated clang section"	commit \| commitdiff \| tree
2013-02-12	Mark Abraham	Merge "Manual reformatting in preparation for uncrustify."	commit \| commitdiff \| tree
2013-02-12	Mark Abraham	Merge "Fix gmxcheck target"	commit \| commitdiff \| tree
2013-02-09	Roland Schulz	Merge "Typo fix" into release-4-6	commit \| commitdiff \| tree
2013-02-08	Mark Abraham	Merge "added back cuda.h includes to fix missing CUDA_VERSIO...	commit \| commitdiff \| tree
2013-02-08	Mark Abraham	Merge "Fixed flop counting for generic cg/adress kernels...	commit \| commitdiff \| tree
2013-02-08	Mark Abraham	Merge "cmake: fixed typo in template CMakeLists.txt...	commit \| commitdiff \| tree
2013-02-05	Christoph Junghans	Merge "Documented what GMX_CPU_ACCELERATION really...	commit \| commitdiff \| tree
2013-02-05	Mark Abraham	Merge "improved load balancing on the GPU" into release-4-6	commit \| commitdiff \| tree
2013-02-01	Berk Hess	PME-only counters are now reset with -maxh -resethway	commit \| commitdiff \| tree
2013-01-25	Christoph Junghans	Merge "Moved a few comments back into position" into...	commit \| commitdiff \| tree
2013-01-22	Mark Abraham	Merge "Illegal acceleration defaulted to QPX" into...	commit \| commitdiff \| tree
2013-01-22	Mark Abraham	Merge "Re-licenced FindGROMACS.cmake (was written by...	commit \| commitdiff \| tree
2013-01-22	Roland Schulz	Illegal acceleration defaulted to QPX	commit \| commitdiff \| tree
2013-01-22	Mark Abraham	Merge "Fix TOUPPER usage" into release-4-6	commit \| commitdiff \| tree
2013-01-22	Mark Abraham	Merge "Updated html manual to 4.6" into release-4-6	commit \| commitdiff \| tree
2013-01-22	Mark Abraham	Merge "added missing cleanup of some nbnxn_cuda data...	commit \| commitdiff \| tree
2013-01-22	Roland Schulz	Fix TOUPPER usage	commit \| commitdiff \| tree
2013-01-22	Roland Schulz	Updated html manual to 4.6	commit \| commitdiff \| tree
2013-01-21	Christoph Junghans	Merge "Set version info for 4.6.x release series" into...	commit \| commitdiff \| tree
2013-01-18	Mark Abraham	Set version info for 4.6.x release series	commit \| commitdiff \| tree
2013-01-18	Mark Abraham	New major release: 4.6	commit \| commitdiff \| tree
2013-01-18	Michael Shirts	Addendum for expanded ensemble options plus formatting...	commit \| commitdiff \| tree
2013-01-18	Roland Schulz	Fix typo	commit \| commitdiff \| tree
2013-01-18	Roland Schulz	Code beautification with uncrustify	commit \| commitdiff \| tree
2013-01-18	Roland Schulz	Add colon after macro to help uncrustify	commit \| commitdiff \| tree
2013-01-18	Berk Hess	thread affinity now uses some topology information	commit \| commitdiff \| tree
2013-01-18	Mark Abraham	Fixing copyright issues and code contributors	commit \| commitdiff \| tree
2013-01-18	Erik Lindahl	Merge "remove unnecessary cmake messages" into release-4-6	commit \| commitdiff \| tree
2013-01-18	Erik Lindahl	Merge "fix OpenMP detection on Mac OS broken by a6fee0b...	commit \| commitdiff \| tree
2013-01-18	Szilárd Páll	fix OpenMP detection on Mac OS broken by a6fee0b	commit \| commitdiff \| tree
2013-01-17	Szilárd Páll	added missing cleanup of some nbnxn_cuda data	commit \| commitdiff \| tree
2013-01-17	Mark Abraham	Merge "Remove unnecessary ICC flags affecting performance...	commit \| commitdiff \| tree
2013-01-17	Mark Abraham	Merge "improved CUDA kernel performance by pre-loading...	commit \| commitdiff \| tree
2013-01-17	Christoph Junghans	Merge "Added note about make_edi and flooding in ED...	commit \| commitdiff \| tree
2013-01-17	Christoph Junghans	Merge "use the compiler version provided by CMake ...	commit \| commitdiff \| tree
2013-01-17	Roland Schulz	Merge "Merge branch 'release-4-5-patches' into release...	commit \| commitdiff \| tree
2013-01-17	Szilárd Páll	Merge changes I930b316c,Iea4283e0,I103648f8 into release-4-6	commit \| commitdiff \| tree
2013-01-17	Mark Abraham	Merge "Fix trjconv -sub with .trr files" into release...	commit \| commitdiff \| tree
2013-01-17	Mark Abraham	BlueGene/Q installation notes	commit \| commitdiff \| tree
2013-01-17	Christoph Junghans	Merge "note the reason for auto-disabling GPU support...	commit \| commitdiff \| tree
2013-01-17	Mark Abraham	Merge "Added mdp option 'calc-lambda-neighbors'." into...	commit \| commitdiff \| tree
2013-01-17	Roland Schulz	Merge "clarify wording of GPU driver-related notes...	commit \| commitdiff \| tree
2013-01-17	Roland Schulz	Merge "Added check for valid wall_atomtype in .mdp...	commit \| commitdiff \| tree
2013-01-17	Mark Abraham	Fix trjconv -sub with .trr files	commit \| commitdiff \| tree
2013-01-17	Berk Hess	fixed SD+BD integration slowing down with OpenMP threads	commit \| commitdiff \| tree
2013-01-17	Roland Schulz	Run regressiontests from build	commit \| commitdiff \| tree
2013-01-17	Sander Pronk	Added mdp option 'calc-lambda-neighbors'.	commit \| commitdiff \| tree
2013-01-17	Mark Abraham	Finally move OpenMM to contrib	commit \| commitdiff \| tree
2013-01-17	Roland Schulz	Fix confusing gmx_header_config.h include	commit \| commitdiff \| tree
2013-01-17	Szilard Pall	don't use polling with new driver	commit \| commitdiff \| tree
2013-01-17	Christoph Junghans	clean up fortran name mangling	commit \| commitdiff \| tree
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