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alexxy/gromacs.git
2015-04-08 David van der... Fixed incorrect output of gb_algorith as sa_algorithm. commit | commitdiff | tree | snapshot
2015-04-01 Berk HessCorrected force-switch manual section commit | commitdiff | tree | snapshot
2015-03-19 Mark AbrahamMade error message more generic commit | commitdiff | tree | snapshot
2015-03-17 Roland SchulzFix linking with static libxml2 commit | commitdiff | tree | snapshot
2015-03-05 Mark AbrahamFix Andersen thermostats commit | commitdiff | tree | snapshot
2015-02-24 Ake SandgrenThe test for HAVE_CXX11_REGEX fails since it doesn... commit | commitdiff | tree | snapshot
2015-02-24 Ake SandgrenChecks should use correct CMAKE_REQUIRED_ variables commit | commitdiff | tree | snapshot
2015-02-14 Erik Marklundgmx hbond no longer removes PBC when none is present commit | commitdiff | tree | snapshot
2015-02-12 Vedran MiletićFix removal of symlinks created during installation commit | commitdiff | tree | snapshot
2015-02-12 Roland SchulzMerge release-4-6 into release-5-0 commit | commitdiff | tree | snapshot
2015-02-12 Berk HessRe-fixed PME bug with high OpenMP thread count commit | commitdiff | tree | snapshot
2015-02-04 Berk HessCorrect CUDA kernel energy flag commit | commitdiff | tree | snapshot
2015-02-02 Mark AbrahamAvoid near-silent generation of zero energies commit | commitdiff | tree | snapshot
2015-02-02 Mark AbrahamFix use of simd.h commit | commitdiff | tree | snapshot
2015-01-23 Mark AbrahamUpdate FindCUDA work-around commit | commitdiff | tree | snapshot
2015-01-21 Berk HessCorrected RDTSCP warning text commit | commitdiff | tree | snapshot
2015-01-16 Mark AbrahamFix BlueGene/Q build with recent CMake commit | commitdiff | tree | snapshot
2015-01-15 Berk HessFix allocation issue with VV integrator commit | commitdiff | tree | snapshot
2015-01-14 Mark AbrahamFix and suppress warnings on BlueGene/Q commit | commitdiff | tree | snapshot
2015-01-08 Mark AbrahamHandle ivec* correctly in DD error message commit | commitdiff | tree | snapshot
2014-12-22 Berk HessFixed pbc=xy + 2 walls + Verlet scheme commit | commitdiff | tree | snapshot
2014-12-22 Berk HessFix bug FE + GPU + 2/3D domain decomposition commit | commitdiff | tree | snapshot
2014-12-18 Roland SchulzFix CMP0054 cmake 3.1.0 warnings commit | commitdiff | tree | snapshot
2014-12-15 Mark AbrahamVersion bumps after new release commit | commitdiff | tree | snapshot
2014-12-15 Mark AbrahamVersion 5.0.4 commit | commitdiff | tree | snapshot
2014-12-15 Mark AbrahamMerge "Merge release-4-6 into release-5-0" into release-5-0 commit | commitdiff | tree | snapshot
2014-12-11 Mark AbrahamMerge release-4-6 into release-5-0 commit | commitdiff | tree | snapshot
2014-12-11 Berk HessAdded grompp error for pulling to negative distance commit | commitdiff | tree | snapshot
2014-12-10 Szilard PallFix nstep command line override print commit | commitdiff | tree | snapshot
2014-12-09 Berk HessFix recent bug with trilinic 1D DD commit | commitdiff | tree | snapshot
2014-12-09 Mark AbrahamVersion bumps after new release commit | commitdiff | tree | snapshot
2014-12-09 Mark AbrahamVersion 5.0.3 commit | commitdiff | tree | snapshot
2014-12-09 Carsten KutznerMake tune_pme understand the "-nsteps" option. Fixes... commit | commitdiff | tree | snapshot
2014-12-08 Berk HessFixed pull coord init with rate!=0, t_start!=0 commit | commitdiff | tree | snapshot
2014-12-08 Mark AbrahamFix group-scheme bug with changing LJ parameters in FE commit | commitdiff | tree | snapshot
2014-12-08 Berk HessAdded PBC note to comm-mode=angular warning commit | commitdiff | tree | snapshot
2014-12-08 Carsten KutznerFixed a typo in the manual. commit | commitdiff | tree | snapshot
2014-12-05 Berk HessClarified grompp pull error messages commit | commitdiff | tree | snapshot
2014-12-05 Berk HessAvoid race on dvdl with Verlet+OpenMP+LINCS+FE+VV commit | commitdiff | tree | snapshot
2014-12-01 Berk HessAdded warning for unnecessary soft-core commit | commitdiff | tree | snapshot
2014-11-29 Christian WennbergFixed typo in amber99sb-ildn force field commit | commitdiff | tree | snapshot
2014-11-27 Mark AbrahamRemove use of interaction_mask_indices on BG/Q commit | commitdiff | tree | snapshot
2014-11-27 Mark AbrahamMerge branch release-4-6 into release-5-0 commit | commitdiff | tree | snapshot
2014-11-26 Roland SchulzFix clang with boost 1.46.1 and 1.47 commit | commitdiff | tree | snapshot
2014-11-26 Ake SandgrenFix problem with mixed affinity mask on different nodes. commit | commitdiff | tree | snapshot
2014-11-26 Berk HessFixed triclinic 1xNx1 domain decomposition commit | commitdiff | tree | snapshot
2014-11-25 Berk HessFixed twin-range + freeze + constraints commit | commitdiff | tree | snapshot
2014-11-24 Berk HessAvoid NaN in rlist buffer calculation commit | commitdiff | tree | snapshot
2014-11-24 Magnus LundborgWhen writing TNG the input must contain molecule data. commit | commitdiff | tree | snapshot
2014-11-24 David van der... Added warnings for ewald-geometry and surface-epsilon commit | commitdiff | tree | snapshot
2014-11-12 Berk HessCorrected parameter for sorting on search grid commit | commitdiff | tree | snapshot
2014-11-12 Berk HessFix DD bonded interaction range print commit | commitdiff | tree | snapshot
2014-11-12 Carsten KutznerUpdated some .mdp file variables to use "-" instead... commit | commitdiff | tree | snapshot
2014-11-09 Justin LemkulRemoved spurious GLY dihedral in AMBER03. commit | commitdiff | tree | snapshot
2014-11-09 Viveca LindahlFixed typo in cmake warning. commit | commitdiff | tree | snapshot
2014-11-09 Roland SchulzBackport valgrind suppression commit | commitdiff | tree | snapshot
2014-10-29 Teemu MurtolaImprove analysis nbsearch grid mapping commit | commitdiff | tree | snapshot
2014-10-28 Teemu MurtolaAvoid common.h inclusion in CUDA code commit | commitdiff | tree | snapshot
2014-10-20 Berk HessRemoved f_novirsum reduction in Verlet scheme commit | commitdiff | tree | snapshot
2014-10-20 Carsten KutznerFix order of ED/swap blocks during checkpoint reading. commit | commitdiff | tree | snapshot
2014-10-17 Mark AbrahamExtend gmock to turn off socket listener commit | commitdiff | tree | snapshot
2014-10-13 Mark AbrahamMerge release-4-6 into release-5-0 commit | commitdiff | tree | snapshot
2014-10-07 Berk HessFixes issue with vsiten and Verlet buffers commit | commitdiff | tree | snapshot
2014-10-06 Mark AbrahamFix trjconv -split not closing files commit | commitdiff | tree | snapshot
2014-10-01 Mark AbrahamVersion bumps after new release commit | commitdiff | tree | snapshot
2014-10-01 Mark AbrahamVersion 5.0.2 commit | commitdiff | tree | snapshot
2014-10-01 Carsten KutznerAllow gmx tune_pme to skip the check for command-line... commit | commitdiff | tree | snapshot
2014-09-30 Szilard PallFix incorrect LJ cut-off with GPU + PME tuning commit | commitdiff | tree | snapshot
2014-09-30 Berk HessAvoid DLB with overloaded PME ranks commit | commitdiff | tree | snapshot
2014-09-30 Berk HessAdded GPU local wait to load balancing commit | commitdiff | tree | snapshot
2014-09-30 Erik LindahlAvoid using function calls in OpenMP directives commit | commitdiff | tree | snapshot
2014-09-29 Berk HessDomain decomposition now checks the rlist buffer commit | commitdiff | tree | snapshot
2014-09-29 Roland SchulzClarify GCC+Win+AVX warning commit | commitdiff | tree | snapshot
2014-09-29 Berk HessSIMD acceleration for RB dihedrals commit | commitdiff | tree | snapshot
2014-09-29 Mark AbrahamMerge "Merge release-4-6 into release-5-0" into release-5-0 commit | commitdiff | tree | snapshot
2014-09-29 Berk HessAvoid PME tuning decreasing rcoulomb commit | commitdiff | tree | snapshot
2014-09-29 Roland SchulzMerge release-4-6 into release-5-0 commit | commitdiff | tree | snapshot
2014-09-29 Berk HessFix calc_grid avoiding PME grid factor 84 commit | commitdiff | tree | snapshot
2014-09-26 Szilárd PállFix incorrect assertion statement commit | commitdiff | tree | snapshot
2014-09-23 David van der... Fixes potential bug in neighborsearching. commit | commitdiff | tree | snapshot
2014-09-22 Roland SchulzFix message about incorrect usage of dihedral type 9 commit | commitdiff | tree | snapshot
2014-09-20 Erik LindahlFix RelWithDebInfo name bugs, and use full optimization. commit | commitdiff | tree | snapshot
2014-09-18 Mark AbrahamMerge branch release-4-6 into release-5-0 commit | commitdiff | tree | snapshot
2014-09-18 Roland SchulzFix double linkage for tests commit | commitdiff | tree | snapshot
2014-09-17 Roland SchulzAdd missing quotes commit | commitdiff | tree | snapshot
2014-09-17 Roland SchulzFix shared libs for Mingw commit | commitdiff | tree | snapshot
2014-09-17 Roland SchulzRemove no-inline-max-size and suppress remark commit | commitdiff | tree | snapshot
2014-09-17 Roland SchulzValgrind suppression for OS X 10.9 commit | commitdiff | tree | snapshot
2014-09-16 Roland SchulzFix warnings for ICC 15 commit | commitdiff | tree | snapshot
2014-09-11 Mark AbrahamRemove documentation references to optimize-fft commit | commitdiff | tree | snapshot
2014-09-11 Erik LindahlEnable static anon namespace workaround on pathscale commit | commitdiff | tree | snapshot
2014-09-09 Szilárd PállFix malformed CUDA version macro check commit | commitdiff | tree | snapshot
2014-09-09 Berk HessFixed DD state collection issue commit | commitdiff | tree | snapshot
2014-09-08 Berk HessCheck for implicit solvent + Verlet scheme commit | commitdiff | tree | snapshot
2014-09-05 Roland SchulzFix build for external boost 1.56.0 commit | commitdiff | tree | snapshot
2014-09-05 Mark AbrahamVersion bumps after new release commit | commitdiff | tree | snapshot
2014-09-05 Mark AbrahamVersion 5.0.1 commit | commitdiff | tree | snapshot
2014-09-04 Roland SchulzAdd Mingw warnings commit | commitdiff | tree | snapshot
2014-09-04 Erik LindahlK-computer specific modifications commit | commitdiff | tree | snapshot
2014-09-04 Christoph Junghanscmake: missing quote commit | commitdiff | tree | snapshot
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