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Documentation house-keeping in file swapcoords.c
[alexxy/gromacs.git] / src /
2014-03-26 Carsten KutznerDocumentation house-keeping in file swapcoords.c tree | commitdiff
2014-03-26 Martin HoeflingInteractive Molecular Dynamics (IMD) tree | commitdiff
2014-03-24 Teemu MurtolaRemove gmxpreprocess from include path tree | commitdiff
2014-03-23 Mark AbrahamMerge branch release-4-6 tree | commitdiff
2014-03-23 Berk HessFixed bug in parallel v/f constraining tree | commitdiff
2014-03-23 Berk HessCUDA cut-off kernels now shift exclusion energies tree | commitdiff
2014-03-23 Mark AbrahamFix print_date_and_time tree | commitdiff
2014-03-18 Roland SchulzFix dependencies on config.h for typedefs.h tree | commitdiff
2014-03-18 Christian WennbergRenaming in PME-routines tree | commitdiff
2014-03-18 Christian WennbergBugfix in LJ-PME without electrostatics tree | commitdiff
2014-03-18 Teemu MurtolaRemove interactive help from core selection parser tree | commitdiff
2014-03-18 Teemu MurtolaImprove interactive selection input tree | commitdiff
2014-03-17 Rossen ApostolovCleaned up endif/else-s in CMakeLists.txt and *.cmake... tree | commitdiff
2014-03-17 Mark AbrahamHouse-keeping for MTTK tree | commitdiff
2014-03-17 Mark AbrahamMerge "Merge branch release-4-6" tree | commitdiff
2014-03-17 Mark AbrahamMerge branch release-4-6 tree | commitdiff
2014-03-17 Mark AbrahamFix perturbation to Verlet scheme when not perturbing tree | commitdiff
2014-03-16 Erik LindahlUse a constant instead of sizeof(int) for SSE2 immediat... tree | commitdiff
2014-03-14 Carsten KutznerAvoid cross product with zero vector in rotational... tree | commitdiff
2014-03-14 Carsten KutznerThe van der Waals radius must equal the Coulomb radius... tree | commitdiff
2014-03-11 Christoph JunghansInstall enums.h tree | commitdiff
2014-03-11 Mark AbrahamAvoid array-bounds warnings with gcc 4.8.2 tree | commitdiff
2014-03-11 Rossen ApostolovRemoved .itp files from top level directory. tree | commitdiff
2014-03-11 Berk HessPME load balancing now works with LJ-PME tree | commitdiff
2014-03-11 Teemu MurtolaFix misc. Doxygen issues tree | commitdiff
2014-03-11 Roland SchulzDon't disable MSVC warnings in config.h tree | commitdiff
2014-03-11 Roland SchulzReplace inline with gmx_inline tree | commitdiff
2014-03-10 Mark AbrahamFix dependency on swapcoords enums tree | commitdiff
2014-03-08 Teemu MurtolaRemove some unnecessary declarations tree | commitdiff
2014-03-06 Rossen ApostolovRemoved the deprecated gmx.ff and gmx2.ff. tree | commitdiff
2014-03-06 Roland SchulzUse gmx_int64_t for gmx_off_t tree | commitdiff
2014-03-06 Berk HessFixed exit with FEP with PME nodes without LJ-PME tree | commitdiff
2014-03-06 ngogaMartini CG - Combined angle-torsion potentials tree | commitdiff
2014-03-05 Roland SchulzRemove dependency on TNG in trxio.h tree | commitdiff
2014-03-05 Roland SchulzReport MIC SIMD correctly tree | commitdiff
2014-03-05 Mark AbrahamMerge "Merge release-4-6 into master" tree | commitdiff
2014-03-05 Berk HessBuffer estimate now works with rvd-switch=0 tree | commitdiff
2014-03-05 Roland SchulzAvoid segfault when comparing tpr tree | commitdiff
2014-03-04 Mark AbrahamAdd enum and docs for using tpx_version tree | commitdiff
2014-03-03 Roland SchulzMerge release-4-6 into master tree | commitdiff
2014-03-03 Mark AbrahamFix calling SIMD group kernels tree | commitdiff
2014-03-02 Teemu MurtolaFix incorrect grid cell size in g_sas -nopbc tree | commitdiff
2014-03-01 Teemu MurtolaMove default library path search to program context tree | commitdiff
2014-03-01 Mark AbrahamAdd fatal error for Andersen+constraints+DD tree | commitdiff
2014-03-01 Christoph Junghansswitch ld_seed from int to gmx_int64_t tree | commitdiff
2014-03-01 Szilard PallAdded CUDA LJ-PME nbnxn kernels tree | commitdiff
2014-03-01 Magnus LundborgBumped TNG to latest version. tree | commitdiff
2014-02-28 Szilard PallImproved CUDA non-bonded kernel performance tree | commitdiff
2014-02-28 Teemu MurtolaResidual SIMD Doxygen improvements tree | commitdiff
2014-02-28 Teemu MurtolaConvert gmx-sas to the C++ framework tree | commitdiff
2014-02-28 Teemu MurtolaAdd support for non-uniform X axis in array data tree | commitdiff
2014-02-27 Teemu MurtolaImprove support for data sets in C++ tools tree | commitdiff
2014-02-27 Szilard PallCUDA kernels for switched LJ tree | commitdiff
2014-02-27 Teemu MurtolaImprove floating point comparisons in unit tests tree | commitdiff
2014-02-26 Berk HessFree-energy now works with the Verlet scheme tree | commitdiff
2014-02-26 Alexey ShvetsovFix -Wmaybe-uninitialized warnings in some files tree | commitdiff
2014-02-26 Erik LindahlAdded message to warn that group kernels are deprecated. tree | commitdiff
2014-02-26 Roland SchulzUse reduce in pme tree | commitdiff
2014-02-26 Erik LindahlRedesigned SIMD module and unit tests. tree | commitdiff
2014-02-26 Roland SchulzReplace all mdrun rngs with cycle based rng tree | commitdiff
2014-02-26 Teemu MurtolaFix GMX_PRIu32 and GMX_PRIu64 for MSVC tree | commitdiff
2014-02-26 Mark AbrahamAdd ThreadSanitizer build type tree | commitdiff
2014-02-25 Berk HessFixes seperate PME nodes without LJ-PME tree | commitdiff
2014-02-25 Mark AbrahamKeep compilers happy on BG/Q tree | commitdiff
2014-02-24 Mark AbrahamClean up options for domain decomposition tree | commitdiff
2014-02-24 Berk HessImplemented LJ-PME nbnxn kernels tree | commitdiff
2014-02-24 Berk HessFixed bug with LJ pot-switch in 4xN kernels tree | commitdiff
2014-02-24 Mark AbrahamPermit warning-free use of Andersen thermostat tree | commitdiff
2014-02-21 Roland SchulzFix load_lj_pair_params2 for MIC tree | commitdiff
2014-02-21 Roland SchulzUpdated Boost to latest 1.55.0 tree | commitdiff
2014-02-21 Roland SchulzMerge "Merge release-4-6 into master" tree | commitdiff
2014-02-21 Roland SchulzMerge release-4-6 into master tree | commitdiff
2014-02-21 Mark AbrahamReinstate shell code with DD tree | commitdiff
2014-02-20 Mark AbrahamRemove particle decomposition tree | commitdiff
2014-02-20 Christoph Junghansadded gmx_is_{single,double}_precision tree | commitdiff
2014-02-20 Roland SchulzFix aligned store to unaligned memory tree | commitdiff
2014-02-20 Mark Abrahamavoid mdrun crash when rdtscp is not supported tree | commitdiff
2014-02-20 Mark AbrahamAdd integration tests for replica exchange tree | commitdiff
2014-02-20 Rossen ApostolovRename ffopen and ffclose to gmx_ff*. tree | commitdiff
2014-02-20 Roland SchulzFix Reference Build tree | commitdiff
2014-02-20 Teemu MurtolaAdd documentation for using Doxygen tree | commitdiff
2014-02-19 Berk HessImplemented nbnxn LJ switch functions tree | commitdiff
2014-02-19 Mark AbrahamMake some variable names less cryptic tree | commitdiff
2014-02-18 Mark AbrahamFix outstanding references to "CPU acceleration" tree | commitdiff
2014-02-18 Mark AbrahamFix harmless bug with combination of group and twin... tree | commitdiff
2014-02-18 Mark AbrahamExtend TestFileManager tree | commitdiff
2014-02-16 Mark AbrahamFix test reference data accidentally broken tree | commitdiff
2014-02-16 Mark AbrahamRemove support for .g87 and .xyz I/O formats tree | commitdiff
2014-02-16 Teemu MurtolaImprove man page formatting slightly tree | commitdiff
2014-02-16 Teemu MurtolaFix default enum values in help output tree | commitdiff
2014-02-13 Magnus LundborgOne more bump of the TNG version. tree | commitdiff
2014-02-12 Magnus LundborgBumped TNG to latest version. tree | commitdiff
2014-02-12 Mark AbrahamRefactored 'solvate' and 'insert-molecules' tree | commitdiff
2014-02-12 Mark AbrahamRe-fix compiler warnings with scanner.cpp tree | commitdiff
2014-02-11 Mark AbrahamSplit genbox into 'solvate' and 'insert-molecules' tree | commitdiff
2014-02-11 David van der SpoelFixed another vmdio issue. tree | commitdiff
2014-02-11 Erik LindahlFirst part of commit for redesigned SIMD module - namec... tree | commitdiff
2014-02-11 Magnus LundborgAdded information about how to cite the TNG paper. tree | commitdiff
2014-02-11 Jan Henning PetersAdded safety check for fitting group in anaeig. tree | commitdiff
2014-02-10 David van der SpoelMoved conditional cmake code for vmdio. tree | commitdiff
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