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Merge "Add histogram output for 'gmx gangle'."
[alexxy/gromacs.git] / src /
2013-04-12 David van der SpoelMerge "Add histogram output for 'gmx gangle'." tree | commitdiff
2013-03-26 Teemu MurtolaAdd histogram output for 'gmx gangle'. tree | commitdiff
2013-03-24 Teemu MurtolaMerge libgmxana into libgromacs. tree | commitdiff
2013-03-22 Roland SchulzFix problems with intel-mpi tree | commitdiff
2013-03-22 Teemu MurtolaMerge "Merge release-4-6 into master" tree | commitdiff
2013-03-20 Roland SchulzMerge release-4-6 into master tree | commitdiff
2013-03-08 Teemu MurtolaBetter test assertions for exceptions. tree | commitdiff
2013-03-07 Teemu MurtolaImprove enum option interface. tree | commitdiff
2013-03-07 Teemu MurtolaMore flexible handling of enum option descriptions. tree | commitdiff
2013-03-07 Teemu MurtolaFix copyright notices for new C++ code. tree | commitdiff
2013-03-07 Teemu MurtolaUpdate my e-mail address on author lines. tree | commitdiff
2013-03-07 Teemu MurtolaMerge "Uncrustify template.cpp and selection.cpp." tree | commitdiff
2013-03-07 Teemu MurtolaMerge "Merge release-4-6 into master" tree | commitdiff
2013-03-06 Roland SchulzMerge "fixed PME time print with -ntomp_pme != -ntomp... tree | commitdiff
2013-03-05 Berk Hessfixed bug with DD cut-off check and PME DLB tree | commitdiff
2013-03-05 Berk Hessfixed recent bug with sorting atoms for GPUs tree | commitdiff
2013-03-02 Christoph JunghansMerge "Uncrustified code changes since 4.6" into releas... tree | commitdiff
2013-02-28 Peter KassonDeclaration-definition consistency nbxn_cuda_wait_gpu. tree | commitdiff
2013-02-26 Berk Hessfixed PME time print with -ntomp_pme != -ntomp tree | commitdiff
2013-02-26 Roland SchulzMerge release-4-6 into master tree | commitdiff
2013-02-26 Christoph JunghansMerge "Merge release-4-6 into master" tree | commitdiff
2013-02-26 Mark AbrahamUncrustified code changes since 4.6 tree | commitdiff
2013-02-25 Teemu MurtolaUncrustify template.cpp and selection.cpp. tree | commitdiff
2013-02-25 Michael Shirtsfix imcompatibility with tpr vers<64 with free energy... tree | commitdiff
2013-02-20 Berk Hessfixed issues with FEP soft-core and cut-off's tree | commitdiff
2013-02-20 Mark AbrahamMerge release-4-5-patches into release-4-6 tree | commitdiff
2013-02-18 Berk Hessfixed GPU particle gridding performance issue tree | commitdiff
2013-02-18 Carsten KutznerMade g_tune_pme work with 4.6 if user sets "-p" command... tree | commitdiff
2013-02-16 Roland SchulzAdd missing include tree | commitdiff
2013-02-15 Michael Shirtsbugfix for md-vv + nose-hoover + (nstcalcenergy > nsttc... tree | commitdiff
2013-02-15 Mark AbrahamUse explicit kernel pointer typecasts tree | commitdiff
2013-02-15 Mark AbrahamMerge "Minor fixes to Verlet kernels" into release-4-6 tree | commitdiff
2013-02-15 Mark AbrahamMerge "improved PME load balancing reporting" into... tree | commitdiff
2013-02-15 Mark AbrahamMerge "Re-generated group kernels" into release-4-6 tree | commitdiff
2013-02-15 Mark AbrahamMerge "Unwinds flag dependencies in g_order." into... tree | commitdiff
2013-02-15 David van der SpoelMerge "Fixed an initialization issue in gmx_dipoles... tree | commitdiff
2013-02-15 Mark AbrahamMerge "use legacy CUDA non-bonded kernels only on Fermi... tree | commitdiff
2013-02-15 Mark AbrahamMerge "More descriptive Verlet kernel macro parameter... tree | commitdiff
2013-02-15 Sander PronkFixed an initialization issue in gmx_dipoles. tree | commitdiff
2013-02-15 Berk Hessimproved PME load balancing reporting tree | commitdiff
2013-02-15 Mark AbrahamMinor fixes to Verlet kernels tree | commitdiff
2013-02-15 Peter KassonUnwinds flag dependencies in g_order. tree | commitdiff
2013-02-15 Mark AbrahamMerge "Fix and add Verlet kernel error messages" into... tree | commitdiff
2013-02-13 Teemu MurtolaFix velocity and force evaluation for empty selections. tree | commitdiff
2013-02-13 Teemu MurtolaChange ConstArrayRef constructor argument order. tree | commitdiff
2013-02-13 Teemu MurtolaAdd continuous array accessors for selection data. tree | commitdiff
2013-02-13 Teemu MurtolaAdd tests for selection mass evaluation and fix it. tree | commitdiff
2013-02-13 Sander PronkMerge "Fix code bug with thread-MPI on PowerPC with... tree | commitdiff
2013-02-13 Roland SchulzMerge "Fixed the MPI recognition string in g_tune_pme... tree | commitdiff
2013-02-13 Roland SchulzMerge "improve setup of multiple tf tables" into releas... tree | commitdiff
2013-02-13 Roland SchulzMerge release-4-6 into master tree | commitdiff
2013-02-13 Roland SchulzMerge release-4-6 into master tree | commitdiff
2013-02-13 Roland SchulzCode beautification with uncrustify tree | commitdiff
2013-02-13 David van der SpoelPlain text quotes. tree | commitdiff
2013-02-13 Mark AbrahamMore descriptive Verlet kernel macro parameter names tree | commitdiff
2013-02-13 Mark AbrahamFix and add Verlet kernel error messages tree | commitdiff
2013-02-13 Mark AbrahamRe-generated group kernels tree | commitdiff
2013-02-13 Sander PronkAdded extra check in for setaffinity support. tree | commitdiff
2013-02-13 Carsten KutznerFixed the MPI recognition string in g_tune_pme tree | commitdiff
2013-02-13 Roland SchulzMerge "Updated FindGSL.cmake to version written by... tree | commitdiff
2013-02-12 Mark AbrahamMerge "PME-only counters are now reset with -maxh ... tree | commitdiff
2013-02-12 Mark AbrahamMerge "fixed bug with sd integrator and OpenMP threadin... tree | commitdiff
2013-02-12 Mark AbrahamMerge "Fix CUDA_HOST_COMPILER flag name" into release-4-6 tree | commitdiff
2013-02-12 Mark AbrahamMerge "Remove duplicated clang section" tree | commitdiff
2013-02-12 Mark AbrahamMerge "Manual reformatting in preparation for uncrustify." tree | commitdiff
2013-02-12 Mark AbrahamMerge "Fix gmxcheck target" tree | commitdiff
2013-02-10 Teemu MurtolaManual reformatting in preparation for uncrustify. tree | commitdiff
2013-02-10 Szilárd Pálluse legacy CUDA non-bonded kernels only on Fermi tree | commitdiff
2013-02-09 Roland SchulzMerge "Typo fix" into release-4-6 tree | commitdiff
2013-02-09 Mark AbrahamTypo fix tree | commitdiff
2013-02-08 Roland SchulzRemove dummy.cpp tree | commitdiff
2013-02-08 Mark AbrahamMerge "added back cuda.h includes to fix missing CUDA_V... tree | commitdiff
2013-02-08 Mark AbrahamMerge "Fixed flop counting for generic cg/adress kernel... tree | commitdiff
2013-02-08 Mark AbrahamMerge "cmake: fixed typo in template CMakeLists.txt... tree | commitdiff
2013-02-06 Berk Hessfixed bug with sd integrator and OpenMP threading tree | commitdiff
2013-02-05 Christoph JunghansMerge "Documented what GMX_CPU_ACCELERATION really... tree | commitdiff
2013-02-05 Christoph Junghansimprove setup of multiple tf tables tree | commitdiff
2013-02-05 Mark AbrahamMerge "improved load balancing on the GPU" into release-4-6 tree | commitdiff
2013-02-05 Berk Hessimproved load balancing on the GPU tree | commitdiff
2013-02-04 Berk Hessfixed segv in init_forcerec with fr->hwinfo=NULL tree | commitdiff
2013-02-02 Christoph JunghansFixed flop counting for generic cg/adress kernels tree | commitdiff
2013-02-01 Berk HessPME-only counters are now reset with -maxh -resethway tree | commitdiff
2013-01-29 Sebastian FritschAdResS: fixes bug in the neighbour list routine tree | commitdiff
2013-01-25 Christoph Junghansfixed copyright of adress kernel tree | commitdiff
2013-01-25 Christoph JunghansMerge "Moved a few comments back into position" into... tree | commitdiff
2013-01-24 Han Wangfix invalid read in construct_vsites tree | commitdiff
2013-01-24 Szilard Palladded back cuda.h includes to fix missing CUDA_VERSION tree | commitdiff
2013-01-22 Mark AbrahamMerge "Re-licenced FindGROMACS.cmake (was written by... tree | commitdiff
2013-01-22 Mark AbrahamMerge "Fix TOUPPER usage" into release-4-6 tree | commitdiff
2013-01-22 Mark AbrahamMerge "Updated html manual to 4.6" into release-4-6 tree | commitdiff
2013-01-22 Mark AbrahamMerge "added missing cleanup of some nbnxn_cuda data... tree | commitdiff
2013-01-22 Carsten KutznerMoved a few comments back into position tree | commitdiff
2013-01-21 Christoph JunghansMerge "Set version info for 4.6.x release series" into... tree | commitdiff
2013-01-21 Roland SchulzMerge release-4-6 into master tree | commitdiff
2013-01-20 Roland SchulzMerge release-4-6 into master tree | commitdiff
2013-01-19 Roland SchulzFix AVX double compile error tree | commitdiff
2013-01-18 Roland SchulzMerge release-4-5-patches into release-4-6 tree | commitdiff
2013-01-18 Roland SchulzCode beautification with uncrustify tree | commitdiff
2013-01-18 Roland SchulzAdd colon after macro to help uncrustify tree | commitdiff
2013-01-18 Berk Hessthread affinity now uses some topology information tree | commitdiff
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