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enable GPU emulation without GPU support
[alexxy/gromacs.git] / src /
2012-11-28 Szilard Pallenable GPU emulation without GPU support 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 Erik LindahlMerge "fixed bug in nbnxn OpenMP non-bonded force reduc... tree | commitdiff
2012-11-27 David van der SpoelMerge "Merge release-4-5-patches into release-4-6"... tree | commitdiff
2012-11-27 Berk Hessfixed bug in nbnxn OpenMP non-bonded force reduction tree | commitdiff
2012-11-27 Sander PronkAdded affinity support check, visibility macros in... tree | commitdiff
2012-11-26 Sander PronkFixed issues with g_bar help text. 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 Erik LindahlMerge "Use stat for gmx_is_file. Fix get_libdir with... tree | commitdiff
2012-11-26 Berk Hessmade nbnxn analytical Ewald consistent tree | commitdiff
2012-11-26 Mark AbrahamClean up some mathematical constants tree | commitdiff
2012-11-26 Sander PronkMade the linear extrapolation in g_bar non-default... tree | commitdiff
2012-11-26 Erik LindahlMerge "Extended build information output and reference... tree | commitdiff
2012-11-26 David van der SpoelFixes #1035 NaN in g_cluster output. 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
2012-11-24 Roland SchulzUse stat for gmx_is_file. Fix get_libdir with symlinks. 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
2012-11-23 Szilard Pallremoved group non-boneded call with verlet scheme tree | commitdiff
2012-11-23 Roland SchulzMerge changes I88f0dcef,I86b2a8cf,I70fb7e6d into releas... tree | commitdiff
2012-11-22 Erik LindahlFix for icc 13 optimization-related issue and TIP4P... tree | commitdiff
2012-11-22 Erik LindahlImplemented RMS-based force tolerance in gmxcheck tree | commitdiff
2012-11-22 Erik LindahlFixed LJ-14 error in free energy tree | commitdiff
2012-11-22 Mark AbrahamSpeed up mdlib compilation by reordering file globs tree | commitdiff
2012-11-20 Christoph JunghansMerge "Fix g_msd -mol" into release-4-6 tree | commitdiff
2012-11-20 Christoph JunghansMerge "Fixes bug in g_hbond that makes it produce fatal... tree | commitdiff
2012-11-20 David van der SpoelFixes bug in g_hbond that makes it produce fatal error. 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 David van der SpoelMerge "Added grompp warning" into release-4-6 tree | commitdiff
2012-11-17 David van der SpoelMerge "Remove rest of the xml support" into release-4-6 tree | commitdiff
2012-11-17 Roland SchulzMerge "Removing Zn and Ar non-OPLS atom types" into... tree | commitdiff
2012-11-16 Mark AbrahamAdded grompp warning tree | commitdiff
2012-11-16 Christoph JunghansRemove rest of the xml support 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
2012-11-16 Roland SchulzRemoves unused files tree | commitdiff
2012-11-16 Berk Hessreduced the cost of the nbnxn OpenMP nb-force reduction tree | commitdiff
2012-11-15 Christoph JunghansMerge "Test that compiling and linking of AVX works... tree | commitdiff
2012-11-15 Berk Hessfixed incorrect 1-4 energies with OpenMP + energy groups tree | commitdiff
2012-11-14 Berk Hessfixed nbnxn x86 SIMD non-bonded performance regression tree | commitdiff
2012-11-13 Erik LindahlRemoved some unnecessary instructions, and fixed a... tree | commitdiff
2012-11-12 Roland SchulzMerge "Backport ThreadMPI.cmake version from master... tree | commitdiff
2012-11-12 Roland SchulzMerge "nbnxn CPU force buffer reduction now uses SIMD... tree | commitdiff
2012-11-12 Berk Hessnbnxn CPU force buffer reduction now uses SIMD tree | commitdiff
2012-11-12 David van der SpoelFixes #1020 options in g_enemat 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 Roland SchulzFix g_msd -mol tree | commitdiff
2012-11-10 Teemu MurtolaRemove obsolete GMX_THREAD_SHM_FDECOMP. tree | commitdiff
2012-11-09 Roland SchulzFix component for libcudart tree | commitdiff
2012-11-09 Erik LindahlRemoved old (now unused) bluegene kernels. tree | commitdiff
2012-11-09 Erik LindahlRemoved unused old kernel generator tree | commitdiff
2012-11-09 Erik LindahlRemoval of stale Fortran/Power6 kernels tree | commitdiff
2012-11-09 Erik LindahlRemoval of stale Fortran kernels tree | commitdiff
2012-11-09 KassonMerge "only use CPU_COUNT if it's available" into relea... tree | commitdiff
2012-11-09 Szilard Pallonly use CPU_COUNT if it's available 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 Erik LindahlFixed bug in the new switch-modified interactions in... tree | commitdiff
2012-11-08 Erik LindahlAllow rcoulomb=rlistlong for PME with nstcalclr=1 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
2012-11-07 Christoph JunghansObey DSO standard tree | commitdiff
2012-11-07 Szilard Palldetect externally set CPU affinity tree | commitdiff
2012-11-06 Roland SchulzMerge "Clarification of mdp_opt, add nstexpand defaults... tree | commitdiff
2012-11-06 Berk HessMerge "Add option to install libcudart" into release-4-6 tree | commitdiff
2012-11-06 Michael ShirtsClarification of mdp_opt, add nstexpand defaults &... tree | commitdiff
2012-11-06 Berk HessMerge "don't execute any mpi_info/mpiname in the path... tree | commitdiff
2012-11-06 Carsten KutznerMade g_tune_pme work correctly when ir->init_step > 0 tree | commitdiff
2012-11-05 Berk HessMerge "updated several things related with OpenMP threa... tree | commitdiff
2012-11-05 Roland SchulzAdd option to install libcudart tree | commitdiff
2012-11-05 Berk Hessupdated several things related with OpenMP thread count 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
2012-10-27 Christoph JunghansMerge "Fix large file support" into release-4-5-patches tree | commitdiff
2012-10-26 Roland SchulzFix usage of CMAKE_REQUIRED_* tree | commitdiff
2012-10-26 Roland SchulzMerge "fixed incorrect PME load balancing limitation... tree | commitdiff
2012-10-26 Christoph JunghansMerge "enable GMX_PREFER_STATIC_LIBS CMake option on... tree | commitdiff
2012-10-26 Christoph JunghansMerge "fix false positive gcc 4.7 warning in libxdrf... tree | commitdiff
2012-10-26 David van der SpoelMerge "Fixed Pulp Fiction quote" into release-4-5-patches tree | commitdiff
2012-10-26 Berk Hessfixed incorrect PME load balancing limitation tree | commitdiff
2012-10-26 Roland SchulzMerge "set the default for nstdhdl to 100" into release-4-6 tree | commitdiff
2012-10-26 Berk Hessset the default for nstdhdl to 100 tree | commitdiff
2012-10-26 Berk Hessfixed incorrect group energies with nbnxn CPU kernels tree | commitdiff
2012-10-25 Roland SchulzMerge "fix CUDA non-bonded kernel pointer assignment... tree | commitdiff
2012-10-25 Szilárd Pállfix false positive gcc 4.7 warning in libxdrf tree | commitdiff
2012-10-23 Berk Hessfixed bondfree.c thread safety with free energy tree | commitdiff
2012-10-23 Roland SchulzMerge "moved part of nbnxn_search.c to nbnxn_atomdata... tree | commitdiff
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