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alexxy/gromacs.git
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
2014-09-03 Roland SchulzFix MingW build commit | commitdiff | tree | snapshot
2014-09-03 Erik LindahlFixed sc_power==48 crash in single precision commit | commitdiff | tree | snapshot
2014-09-03 Mark AbrahamFix mis-use of fabs in LAPACK commit | commitdiff | tree | snapshot
2014-09-03 Mark AbrahamMore hacking to get the template to detect and build commit | commitdiff | tree | snapshot
2014-09-03 Roland SchulzFix that TNG tests were not run commit | commitdiff | tree | snapshot
2014-09-03 Erik LindahlFixed preprocessor error for AVX_128_FMA simd commit | commitdiff | tree | snapshot
2014-09-02 Erik LindahlFix formatting of fatal errors in g_bar commit | commitdiff | tree | snapshot
2014-09-02 Roland SchulzFix PRINT_ALLOC_KB output commit | commitdiff | tree | snapshot
2014-09-02 Magnus LundborgTNG Fix for GMX_DOUBLE builds and where ZLIB is not... commit | commitdiff | tree | snapshot
2014-09-02 Magnus LundborgFix data block length when uncompressing TNG data. commit | commitdiff | tree | snapshot
2014-09-02 Erik LindahlFixed string var expansion in CMake due to CMP0053 commit | commitdiff | tree | snapshot
2014-09-01 Magnus LundborgTNG: Handle large files on 32 bit systems. commit | commitdiff | tree | snapshot
2014-09-01 Justin LemkulUpdated x-axis label for g_wham. commit | commitdiff | tree | snapshot
2014-09-01 Magnus LundborgWhen writing TNG include file closing in wallcycle. commit | commitdiff | tree | snapshot
2014-09-01 Mark AbrahamFix and document issues with template.cpp commit | commitdiff | tree | snapshot
2014-09-01 Mark AbrahamMerge "Merge branch release-4-6 into release-5-0" into... commit | commitdiff | tree | snapshot
2014-09-01 Mark AbrahamFixes and updates to BlueGene/Q support commit | commitdiff | tree | snapshot
2014-09-01 Mark AbrahamMerge branch release-4-6 into release-5-0 commit | commitdiff | tree | snapshot
2014-09-01 Mark AbrahamMerge "Merge branch release-4-6 into release-5-0" into... commit | commitdiff | tree | snapshot
2014-08-31 Erik LindahlAdded negative zero preprocessor constants commit | commitdiff | tree | snapshot
2014-08-30 David van der... Fixes issue with vsiten and verlet buffers. commit | commitdiff | tree | snapshot
2014-08-29 Mark AbrahamVersion bump after 4.6.7 commit | commitdiff | tree | snapshot
2014-08-29 Mark AbrahamMerge branch release-4-6 into release-5-0 commit | commitdiff | tree | snapshot
2014-08-28 Berk HessFixed two PME issues with MPI+OpenMP commit | commitdiff | tree | snapshot
2014-08-25 Berk HessFixed bugs in vsiteN with OpenMP commit | commitdiff | tree | snapshot
2014-08-24 Berk HessInitialize unused velocity constraint components commit | commitdiff | tree | snapshot
2014-08-23 Teemu MurtolaBackport of 'Remove unused figures from share/html/' commit | commitdiff | tree | snapshot
2014-08-23 Mark AbrahamGeneralize markdown configuration machinery commit | commitdiff | tree | snapshot
2014-08-23 Mark AbrahamUnify documentation for webpage build commit | commitdiff | tree | snapshot
2014-08-22 Mark AbrahamFix zlib usage with TNG commit | commitdiff | tree | snapshot
2014-08-21 Magnus LundborgFixed TNG memory alignment problem and reset pointers. commit | commitdiff | tree | snapshot
2014-08-20 Erik LindahlAdd _GNU_SOURCE=1 to find clone() with PGI commit | commitdiff | tree | snapshot
2014-08-20 Roland SchulzChange error to warning for missing OMP_NUM_THREADS commit | commitdiff | tree | snapshot
2014-08-20 Erik LindahlFix matrix pointer dereference bug in update.c commit | commitdiff | tree | snapshot
2014-08-20 Erik LindahlEnable SIMD register calling convention with gmx_simdcall commit | commitdiff | tree | snapshot
2014-08-20 Erik LindahlAdd cycle counters for 64-bit ARM commit | commitdiff | tree | snapshot
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