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

biod.pnpi.spb.ru / alexxy / gromacs.git / history

[alexxy/gromacs.git] / src / mdlib / forcerec.c

2013-01-18	Mark Abraham	Fixing copyright issues and code contributors	blob \| commitdiff \| raw
2013-01-17	Mark Abraham	Merge branch 'release-4-5-patches' into release-4-6	blob \| commitdiff \| raw \| diff to current
2013-01-16	Erik Lindahl	Fixed GB interactions for release-4-6	blob \| commitdiff \| raw \| diff to current
2013-01-16	Berk Hess	split off pick_nbnxn_resource from nbnxn_pick_nbnxn	blob \| commitdiff \| raw \| diff to current
2013-01-15	Mark Abraham	Merge "Hid nbnxn kernel names behind a lookup function...	blob \| commitdiff \| raw \| diff to current
2013-01-14	Mark Abraham	Hid nbnxn kernel names behind a lookup function	blob \| commitdiff \| raw \| diff to current
2013-01-11	Christoph Junghans	Merge "Fix CUDA being quiet and mark all CUDA_* as...	blob \| commitdiff \| raw \| diff to current
2013-01-11	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2013-01-09	Erik Lindahl	Merge "Corrected gmxcheck output for Gromos96 bonds...	blob \| commitdiff \| raw \| diff to current
2013-01-09	Roland Schulz	Merge "[tools] g_sans - add trajectory avereging" into...	blob \| commitdiff \| raw \| diff to current
2013-01-07	Roland Schulz	Merge "cmake: remove double-negative quotes logic"...	blob \| commitdiff \| raw \| diff to current
2013-01-07	Roland Schulz	Merge "Ignore bool cast warning for MSVC and C++" into...	blob \| commitdiff \| raw \| diff to current
2013-01-07	David van der Spoel	Merge "Removed reference to nonexistent file in g_helix...	blob \| commitdiff \| raw \| diff to current
2013-01-07	Roland Schulz	Merge "improved reporting of failed affinity setting...	blob \| commitdiff \| raw \| diff to current
2013-01-07	Roland Schulz	Merge "Fixed format error in online manual." into relea...	blob \| commitdiff \| raw \| diff to current
2013-01-07	Roland Schulz	Merge "Fixed a bug that with multiple exchanges" into...	blob \| commitdiff \| raw \| diff to current
2013-01-07	Roland Schulz	Merge "Essential dynamics: fixed restarts when ED group...	blob \| commitdiff \| raw \| diff to current
2013-01-07	Roland Schulz	Merge "minor speed-up and code clean-up in nbnxn kernel...	blob \| commitdiff \| raw \| diff to current
2013-01-02	Berk Hess	minor speed-up and code clean-up in nbnxn kernels	blob \| commitdiff \| raw \| diff to current
2012-12-20	Erik Lindahl	Merge "cmake: added option to disable quotes" into...	blob \| commitdiff \| raw \| diff to current
2012-12-20	Erik Lindahl	Merge "Small fix for g_tune_pme" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-12-20	Erik Lindahl	Merge "Fixes for andersen temperature control" into...	blob \| commitdiff \| raw \| diff to current
2012-12-20	Erik Lindahl	Merge "Fixes for expanded ensemble and HREPEX" into...	blob \| commitdiff \| raw \| diff to current
2012-12-20	Christoph Junghans	Merge "Fixed AVX256 double-precision kernels for gcc...	blob \| commitdiff \| raw \| diff to current
2012-12-20	Erik Lindahl	Fixed AVX256 double-precision kernels for gcc	blob \| commitdiff \| raw \| diff to current
2012-12-19	Mark Abraham	Merge "Remove the rest of the fortran/power6 accelerati...	blob \| commitdiff \| raw \| diff to current
2012-12-19	Mark Abraham	Merge "Always build template program" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-12-19	Szilárd Páll	Merge "Avoid using undefined CMake variables" into...	blob \| commitdiff \| raw \| diff to current
2012-12-19	Szilárd Páll	Merge "Removed orphan file" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-12-19	Roland Schulz	Merge "Fix license text printed by programs." into...	blob \| commitdiff \| raw \| diff to current
2012-12-19	Roland Schulz	Merge changes Idc652236,If03cf569 into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-12-18	Berk Hess	implemented nbnxn AVX-256 2x(N+N) kernels	blob \| commitdiff \| raw \| diff to current
2012-12-10	Christoph Junghans	Merge "force C++ linking of the gpu_utils" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-12-09	Roland Schulz	Merge "Fix build of template and other external code...	blob \| commitdiff \| raw \| diff to current
2012-12-06	Sebastian Fritsch	Re-enable AdResS feature	blob \| commitdiff \| raw \| diff to current
2012-12-05	Mark Abraham	Merge "don't auto-set nvcc host compiler with cmake...	blob \| commitdiff \| raw \| diff to current
2012-12-05	Mark Abraham	Merge "Keep FindCUDA quiet when it is not useful" into...	blob \| commitdiff \| raw \| diff to current
2012-12-05	Mark Abraham	Merge "Remove TEST_TMPI_ATOMICS_ONLY" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-12-05	Mark Abraham	Merge "Re-apply -dev version name between beta 1 and...	blob \| commitdiff \| raw \| diff to current
2012-12-05	Roland Schulz	Merge "fixed segv in Verlet pair-search with trilinic...	blob \| commitdiff \| raw \| diff to current
2012-12-05	Mark Abraham	Merge "Fixed labelling of g_hbond plots" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-12-05	Roland Schulz	Merge "fixed incorrect virial with virtual sites and...	blob \| commitdiff \| raw \| diff to current
2012-11-30	Berk Hess	fixed issue with -multi and GPUs	blob \| commitdiff \| raw \| diff to current
2012-11-29	Mark Abraham	Update copyright statements and change license to LGPL	blob \| commitdiff \| raw \| diff to current
2012-11-29	Mark Abraham	Merge "automation for setting GMX_GPU & cmake GPU detec...	blob \| commitdiff \| raw \| diff to current
2012-11-29	Szilard Pall	don't print nonbonded kernel info with GMX_NO_NONBONDED	blob \| commitdiff \| raw \| diff to current
2012-11-28	Mark Abraham	Merge "extended nbnxn x86 SIMD kernel blendv support...	blob \| commitdiff \| raw \| diff to current
2012-11-28	Szilárd Páll	Merge changes I9b865c4c,Ib709290e into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-11-28	Szilard Pall	enable GPU emulation without GPU support	blob \| commitdiff \| raw \| diff to current
2012-11-26	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-11-26	Roland Schulz	Merge "Clean up some mathematical constants" into relea...	blob \| commitdiff \| raw \| diff to current
2012-11-26	Berk Hess	made nbnxn analytical Ewald consistent	blob \| commitdiff \| raw \| diff to current
2012-11-26	Erik Lindahl	Merge "Extended build information output and reference...	blob \| commitdiff \| raw \| diff to current
2012-11-26	Berk Hess	added nbnxn analytical Ewald correction kernels	blob \| commitdiff \| raw \| diff to current
2012-11-20	Christoph Junghans	Merge "Fix g_msd -mol" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-11-20	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-11-19	Roland Schulz	Merge changes Ibc555d88,Iaf6f3051 into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-11-19	Roland Schulz	Merge "Remove double declaration in headers" into relea...	blob \| commitdiff \| raw \| diff to current
2012-11-17	Roland Schulz	Remove double declaration in headers	blob \| commitdiff \| raw \| diff to current
2012-11-17	Roland Schulz	Merge "Removing Zn and Ar non-OPLS atom types" into...	blob \| commitdiff \| raw \| diff to current
2012-11-15	Christoph Junghans	Merge "Test that compiling and linking of AVX works...	blob \| commitdiff \| raw \| diff to current
2012-11-15	Berk Hess	fixed incorrect 1-4 energies with OpenMP + energy groups	blob \| commitdiff \| raw \| diff to current
2012-11-08	Roland Schulz	Merge "Fixed bug in the new switch-modified interaction...	blob \| commitdiff \| raw \| diff to current
2012-11-08	Christoph Junghans	Merge "auto-set nvcc host compiler with FindMPI detecti...	blob \| commitdiff \| raw \| diff to current
2012-11-08	Christoph Junghans	Merge "Relocated logic of simple-vs-GPU Ewald table...	blob \| commitdiff \| raw \| diff to current
2012-11-08	Mark Abraham	Relocated logic of simple-vs-GPU Ewald table generation	blob \| commitdiff \| raw \| diff to current
2012-11-08	Erik Lindahl	Infrastructure for new group kernels, and new C kernels	blob \| commitdiff \| raw \| diff to current
2012-11-03	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-10-25	Roland Schulz	Merge "fix CUDA non-bonded kernel pointer assignment...	blob \| commitdiff \| raw \| diff to current
2012-10-23	Roland Schulz	Merge "moved part of nbnxn_search.c to nbnxn_atomdata...	blob \| commitdiff \| raw \| diff to current
2012-10-23	Berk Hess	moved part of nbnxn_search.c to nbnxn_atomdata.c	blob \| commitdiff \| raw \| diff to current
2012-10-17	Kasson	Merge "Make Gromacs compile without C++ compiler" into...	blob \| commitdiff \| raw \| diff to current
2012-10-08	Berk Hess	made non-bonded potential shifts mdp options	blob \| commitdiff \| raw \| diff to current
2012-10-02	Szilard Pall	added Verlet scheme and NxN non-bonded functionality	blob \| commitdiff \| raw \| diff to current
2012-10-01	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-09-03	Szilard Pall	Merge branch 'release-4-5-patches' into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-07-25	Roland Schulz	Merge "cmake: allow switch between single and double...	blob \| commitdiff \| raw \| diff to current
2012-07-25	Roland Schulz	Merge "fix a segfault in sse_mask_init" into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-07-24	Mark Abraham	Clean up of environment variables	blob \| commitdiff \| raw \| diff to current
2012-07-13	Roland Schulz	Merge release-4.5-patches into HEAD	blob \| commitdiff \| raw \| diff to current
2012-06-26	Roland Schulz	Merge "Fix gmx_fatal for serial compilation" into relea...	blob \| commitdiff \| raw \| diff to current
2012-06-25	Berk Hess	added check for log fp!=NULL when disabling acceleration	blob \| commitdiff \| raw \| diff to current
2012-06-24	Michael Shirts	Merge "Fix mdp_opt formatting of expanded ensemble...	blob \| commitdiff \| raw \| diff to current
2012-06-22	Christoph Junghans	Merge "Simple patch for openmm_wrapper.cpp" into releas...	blob \| commitdiff \| raw \| diff to current
2012-06-16	Erik Lindahl	New CPU detection & AVX/SSE code, removed raw assembly...	blob \| commitdiff \| raw \| diff to current
2012-06-04	Michael Shirts	Merging in free energy, exp. ensemble, & andersen t...	blob \| commitdiff \| raw \| diff to current
2012-06-01	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-05-07	Teemu Murtola	Merge branch 'gerrit/release-4-5-patches' into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-04-29	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-04-29	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-04-26	Berk Hess	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-04-25	Berk Hess	replaced PPPM by P3M-AD: a few lines in pme.c	blob \| commitdiff \| raw \| diff to current
2012-04-03	Roland Schulz	Merge remote-tracking branch 'gerrit/release-4-5-patche...	blob \| commitdiff \| raw \| diff to current
2012-03-28	Szilard Pall	Merge branch 'release-4-5-patches' into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-03-18	David van der Spoel	Merge "Merge release-4-5-patches into release-4-6"...	blob \| commitdiff \| raw \| diff to current
2012-03-16	Berk Hess	fixed incorrect table allocation	blob \| commitdiff \| raw \| diff to current
2012-03-16	Roland Schulz	Merge release-4-5-patches into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-03-15	Roland Schulz	Fix most errors found by cppcheck	blob \| commitdiff \| raw \| diff to current
2012-02-29	Szilard Pall	Merge branch 'release-4-5-patches' into release-4-6	blob \| commitdiff \| raw \| diff to current
2012-02-23	Roland Schulz	Merge remote-tracking branch 'gerrit/release-4-5-patche...	blob \| commitdiff \| raw \| diff to current
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