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Merge "Removed reference to nonexistent file in g_helix." into release-4-6
[alexxy/gromacs.git] / include /
2013-01-07 David van der SpoelMerge "Removed reference to nonexistent file in g_helix... tree | commitdiff
2013-01-07 Roland SchulzMerge "improved reporting of failed affinity setting... tree | commitdiff
2013-01-07 Roland SchulzMerge "Fixed format error in online manual." into relea... tree | commitdiff
2013-01-07 Roland SchulzMerge "Fixed a bug that with multiple exchanges" into... tree | commitdiff
2013-01-07 Roland SchulzMerge "Essential dynamics: fixed restarts when ED group... tree | commitdiff
2013-01-07 Roland SchulzMerge "minor speed-up and code clean-up in nbnxn kernel... tree | commitdiff
2013-01-07 Christoph JunghansMerge "Make gmx_cpuid.h self-standing." into release-4-6 tree | commitdiff
2013-01-04 Teemu MurtolaMerge "Minor fixes to g_angle help description." into... tree | commitdiff
2013-01-04 Teemu MurtolaMerge "Fixed error message for zwitterion residues... tree | commitdiff
2013-01-03 Roland SchulzMerge "Fixed GMXRC so we are not polluting standard... tree | commitdiff
2013-01-03 Christoph JunghansMerge "Remove non-functional PowerPC invsqrt." into... tree | commitdiff
2013-01-02 Berk Hessminor speed-up and code clean-up in nbnxn kernels tree | commitdiff
2012-12-30 Erik LindahlMerge "Thread-MPI fixes for i386 llvm & simplification... tree | commitdiff
2012-12-30 Teemu MurtolaRemove non-functional PowerPC invsqrt. tree | commitdiff
2012-12-29 Sander PronkThread-MPI fixes for i386 llvm & simplification of... tree | commitdiff
2012-12-22 Roland SchulzAdd missing visibility exports tree | commitdiff
2012-12-21 Teemu MurtolaMake gmx_cpuid.h self-standing. tree | commitdiff
2012-12-20 Erik LindahlMerge "Small fix for g_tune_pme" into release-4-6 tree | commitdiff
2012-12-20 Carsten KutznerEssential dynamics: fixed restarts when ED group has... tree | commitdiff
2012-12-19 Mark AbrahamMerge "Remove the rest of the fortran/power6 accelerati... tree | commitdiff
2012-12-19 Mark AbrahamMerge "Always build template program" into release-4-6 tree | commitdiff
2012-12-19 Szilárd PállMerge "Avoid using undefined CMake variables" into... tree | commitdiff
2012-12-19 Szilárd PállMerge "Removed orphan file" into release-4-6 tree | commitdiff
2012-12-19 Roland SchulzMerge "Fix license text printed by programs." into... tree | commitdiff
2012-12-19 Roland SchulzMerge changes Idc652236,If03cf569 into release-4-6 tree | commitdiff
2012-12-18 Berk Hessrenamed gmx_x86_simd_macros.h to gmx_simd_macros.h tree | commitdiff
2012-12-18 Berk Hessimplemented nbnxn AVX-256 2x(N+N) kernels tree | commitdiff
2012-12-17 Teemu MurtolaFix license text printed by programs. tree | commitdiff
2012-12-11 Christoph JunghansMerge "Fix compilation with PGI" into release-4-6 tree | commitdiff
2012-12-10 Christoph JunghansMerge "force C++ linking of the gpu_utils" into release-4-6 tree | commitdiff
2012-12-09 Roland SchulzMerge "fixed GPU pair-search with GMX_CPU_ACCELERATION... tree | commitdiff
2012-12-09 Roland SchulzMerge "Fix build of template and other external code... tree | commitdiff
2012-12-06 Michael ShirtsRemoving (inaccurate) virial temperature calc. tree | commitdiff
2012-12-06 Teemu MurtolaFix build of template and other external code. tree | commitdiff
2012-12-06 Sebastian FritschRe-enable AdResS feature tree | commitdiff
2012-12-06 Berk Hessremoved last OpenMP O(nthreads) bottleneck tree | commitdiff
2012-12-05 Mark AbrahamMerge "don't auto-set nvcc host compiler with cmake... tree | commitdiff
2012-12-05 Mark AbrahamMerge "Keep FindCUDA quiet when it is not useful" into... tree | commitdiff
2012-12-05 Mark AbrahamMerge "Remove TEST_TMPI_ATOMICS_ONLY" into release-4-6 tree | commitdiff
2012-12-05 Mark AbrahamMerge "Re-apply -dev version name between beta 1 and... tree | commitdiff
2012-12-05 Roland SchulzMerge "fixed segv in Verlet pair-search with trilinic... tree | commitdiff
2012-12-05 Mark AbrahamMerge "Fixed labelling of g_hbond plots" into release-4-6 tree | commitdiff
2012-12-05 Roland SchulzMerge "fixed incorrect virial with virtual sites and... tree | commitdiff
2012-11-30 Berk Hessfixed issue with -multi and GPUs tree | commitdiff
2012-11-29 Mark AbrahamUpdate copyright statements and change license to LGPL tree | commitdiff
2012-11-29 Szilard Pallmade errors during GPU detection non-fatal tree | commitdiff
2012-11-29 Mark AbrahamMerge "Added .gitignore for kernel generation" into... tree | commitdiff
2012-11-29 Mark AbrahamMerge "Double precision AVX-256 kernels" into release-4-6 tree | commitdiff
2012-11-29 Mark AbrahamMerge "Fixing issue with GPU detection reporting" into... tree | commitdiff
2012-11-29 Mark AbrahamMerge "Double precision AVX_128_FMA kernels" into relea... tree | commitdiff
2012-11-29 Erik LindahlDouble precision AVX-256 kernels tree | commitdiff
2012-11-29 Erik LindahlDouble precision AVX_128_FMA kernels tree | commitdiff
2012-11-28 Mark AbrahamMerge "Fix Window-GPU build" into release-4-6 tree | commitdiff
2012-11-28 Christoph JunghansMerge "Fix cpack src ignore rule" into release-4-6 tree | commitdiff
2012-11-28 Roland SchulzMerge "Remove CVS files" into release-4-6 tree | commitdiff
2012-11-28 Erik Lindahl128-bit AVX kernels, with FMA instructions for Opteron... tree | commitdiff
2012-11-27 Roland SchulzRemove CVS files tree | commitdiff
2012-11-27 Erik LindahlNonbonded group kernels for 256-bit AVX (Intel CPUs) tree | commitdiff
2012-11-27 Michael ShirtsRemoves memory allocation from free energy foreign... tree | commitdiff
2012-11-27 Roland SchulzAdd visibility defines tree | commitdiff
2012-11-27 Erik LindahlMerge "Added affinity support check, visibility macros... tree | commitdiff
2012-11-27 Sander PronkAdded affinity support check, visibility macros in... tree | commitdiff
2012-11-26 Roland SchulzMerge release-4-5-patches into release-4-6 tree | commitdiff
2012-11-26 Roland SchulzMerge "Clean up some mathematical constants" into relea... tree | commitdiff
2012-11-26 Mark AbrahamClean up some mathematical constants tree | commitdiff
2012-11-26 Erik LindahlMerge "Extended build information output and reference... tree | commitdiff
2012-11-26 Berk Hessadded nbnxn analytical Ewald correction kernels tree | commitdiff
2012-11-25 Teemu MurtolaExtended build information output and reference build... tree | commitdiff
2012-11-23 Roland SchulzMerge "removed group non-boneded call with verlet schem... tree | commitdiff
2012-11-23 Roland SchulzMerge "improve FindGROMACS.cmake" into release-4-6 tree | commitdiff
2012-11-23 Roland SchulzForce C++ linking of the gpu_utils tree | commitdiff
2012-11-23 Szilárd PállMerge "Updates to CMake treatment of OpenMP" into relea... tree | commitdiff
2012-11-20 Christoph JunghansMerge "Fix g_msd -mol" into release-4-6 tree | commitdiff
2012-11-20 Roland SchulzMerge release-4-5-patches into release-4-6 tree | commitdiff
2012-11-19 Roland SchulzMerge changes Ibc555d88,Iaf6f3051 into release-4-6 tree | commitdiff
2012-11-19 Mark AbrahamMerge "SSE4.1 single-precision kernels" into release-4-6 tree | commitdiff
2012-11-19 Erik LindahlSSE4.1 single-precision kernels tree | commitdiff
2012-11-19 Roland SchulzMerge "Remove double declaration in headers" into relea... tree | commitdiff
2012-11-17 Roland SchulzRemove double declaration in headers tree | commitdiff
2012-11-17 Roland SchulzMerge "Removing Zn and Ar non-OPLS atom types" into... tree | commitdiff
2012-11-16 David van der SpoelMerge "Removes unused files" into release-4-6 tree | commitdiff
2012-11-16 Erik LindahlSSE2 single-precision kernels tree | commitdiff
2012-11-11 Roland SchulzFix FMA4 compile for GCC and MSVC tree | commitdiff
2012-11-10 Roland SchulzMerge "Fix broken manual formatting" into release-4-6 tree | commitdiff
2012-11-10 Teemu MurtolaRemove obsolete GMX_THREAD_SHM_FDECOMP. tree | commitdiff
2012-11-08 Roland SchulzMerge "Fixed bug in the new switch-modified interaction... tree | commitdiff
2012-11-08 Christoph JunghansMerge "auto-set nvcc host compiler with FindMPI detecti... tree | commitdiff
2012-11-08 Christoph JunghansMerge "Relocated logic of simple-vs-GPU Ewald table... tree | commitdiff
2012-11-08 Mark AbrahamRelocated logic of simple-vs-GPU Ewald table generation tree | commitdiff
2012-11-08 Erik LindahlInfrastructure for new group kernels, and new C kernels tree | commitdiff
2012-11-06 Berk HessMerge "Add option to install libcudart" into release-4-6 tree | commitdiff
2012-11-06 Berk HessMerge "don't execute any mpi_info/mpiname in the path... tree | commitdiff
2012-11-05 Berk HessMerge "updated several things related with OpenMP threa... tree | commitdiff
2012-11-03 Roland SchulzMerge release-4-5-patches into release-4-6 tree | commitdiff
2012-10-31 Szilard Pallfix internal/external OpenMP thread affinity clash tree | commitdiff
2012-10-25 Roland SchulzMerge "fix CUDA non-bonded kernel pointer assignment... tree | commitdiff
2012-10-23 Roland SchulzMerge "moved part of nbnxn_search.c to nbnxn_atomdata... tree | commitdiff
2012-10-23 Berk Hessmoved part of nbnxn_search.c to nbnxn_atomdata.c tree | commitdiff
2012-10-23 Roland SchulzMerge "added OpenMP parallelization for virtual sites... tree | commitdiff
2012-10-22 Berk Hessadded OpenMP parallelization for virtual sites tree | commitdiff
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