biod.pnpi.spb.ru / alexxy / gromacs.git / history
? search:
summary | shortlog | log | commit | commitdiff | tree
first ⋅ prev ⋅ next
Use using for ArrayRef and RVec in pull code
[alexxy/gromacs.git] / docs /
2021-03-29 Andrey AlekseenkoFix webpage build tree | commitdiff
2021-03-27 Mark AbrahamUpdate developer guide on error handling tree | commitdiff
2021-03-26 Szilárd PállAllow setting nbnxm cluster size for SYCL tree | commitdiff
2021-03-16 Kevin BoydMigrate gmx msd to the trajectoryanalysis framework tree | commitdiff
2021-03-13 Paul BauerRemove cyclic dependency check from check-source tree | commitdiff
2021-03-05 Paul BauerRemove physical constant enums tree | commitdiff
2021-03-05 Mark AbrahamIntroduce StringToEnumValue tree | commitdiff
2021-03-03 M. Eric IrrgangCreate a documentation section for GitLab Label guidelines. tree | commitdiff
2021-03-03 Mark AbrahamRemove PDO reading from gmx wham tree | commitdiff
2021-02-18 Pascal MerzImplement velocity terms for virtual sites tree | commitdiff
2021-02-12 Mark AbrahamMerge branch release-2021 into master tree | commitdiff
2021-02-12 Mark AbrahamImprove CUDA codegen flags tree | commitdiff
2021-02-12 Pascal MerzMove virtual site calculation tree | commitdiff
2021-02-11 Paul BauerPrepare changes to docker images for python packages tree | commitdiff
2021-02-10 Berk HessFix gmx_rmpbc_init with InteractionDefinitions tree | commitdiff
2021-02-09 Pascal MerzMake temperature and pressure coupling enums enum classes tree | commitdiff
2021-02-09 Mark AbrahamRemove tree-reduce algorithm tree | commitdiff
2021-02-09 Paul BauerFix range check bug in gmx covar tree | commitdiff
2021-02-08 Andrey AlekseenkoDisable FPE for SYCL builds tree | commitdiff
2021-02-06 Mark AbrahamAdd style code for function static variables tree | commitdiff
2021-02-05 Cathrine BerghUpdated logos tree | commitdiff
2021-02-05 Mark AbrahamRemove VMX SIMD tree | commitdiff
2021-02-04 Mark AbrahamDefine M_PI when it is not defined tree | commitdiff
2021-02-04 Mark AbrahamRemove support for ARMv7 and NEON tree | commitdiff
2021-02-03 Mark AbrahamRemove support for Intel classic compiler tree | commitdiff
2021-02-02 Andrey AlekseenkoRemove deprecated env. vars GMX_OCL_NB_ANA_EWALD etc tree | commitdiff
2021-02-02 Mark AbrahamRemove support for Fujitsu Sparc64 HPC-ACE tree | commitdiff
2021-02-01 Mark AbrahamRemove x86 MIC support tree | commitdiff
2021-02-01 Mark AbrahamAdd necessary include tree | commitdiff
2021-01-31 Mark AbrahamRequire MPI 2.0 tree | commitdiff
2021-01-29 Christian BlauUpdate release note on QM/MM deprication tree | commitdiff
2021-01-29 Roland SchulzUse cxx mpi tree | commitdiff
2021-01-29 Mark AbrahamMerge branch release-2021 tree | commitdiff
2021-01-29 Paul BauerPrepare for first 2021 patch release tree | commitdiff
2021-01-28 Paul BauerGROMACS 2021 release tree | commitdiff
2021-01-28 Andrey AlekseenkoReintroduce CI job descriptions tree | commitdiff
2021-01-27 Pascal MerzRemove constant acceleration groups tree | commitdiff
2021-01-27 Christian BlauClarify lambda vector usage with figure in manual tree | commitdiff
2021-01-26 Szilárd PállChange default Ewald kernel to tabulated on NVIDIA... tree | commitdiff
2021-01-26 Mark AbrahamFix default for xpm2gmx tick-mark spacings tree | commitdiff
2021-01-26 Pascal MerzEnable grompp to read virtual_site1 tree | commitdiff
2021-01-25 Berk HessMTS release note tree | commitdiff
2021-01-21 Mark AbrahamEnsure residue name used by pdb2gmx matches rtp name tree | commitdiff
2021-01-19 Berk HessChange default MTS force group selection tree | commitdiff
2021-01-19 Mark AbrahamDeprecate mdrun -deffnm tree | commitdiff
2021-01-11 Mark AbrahamRemove mdrun-only build configuration tree | commitdiff
2021-01-07 Paul BauerAdd new GROMACS logo tree | commitdiff
2021-01-07 Paul BauerMerge branch release-2020 into merge-2020-into-2021 tree | commitdiff
2021-01-07 Christian BlauPrepare for GROMACS 2020.6 tree | commitdiff
2021-01-06 Christian BlauGROMACS version 2020.5 tree | commitdiff
2021-01-05 Szilárd PállUpdate src/regressiontests URLs to https tree | commitdiff
2021-01-01 Michael ShirtsExpanded ensemble changes. tree | commitdiff
2020-12-23 Mark AbrahamDeprecate .pdo file reading tree | commitdiff
2020-12-18 Mark AbrahamMerge branch release-2021 tree | commitdiff
2020-12-15 Mark AbrahamUpdate deprecation statuses tree | commitdiff
2020-12-14 Paul BauerFix pull group index handling tree | commitdiff
2020-12-14 Magnus LundborgFix incorrect AWH free-energy output with multiple... tree | commitdiff
2020-12-13 Simon ChristCorrect signs of lj and coulomb forces tree | commitdiff
2020-12-11 Andrey AlekseenkoUpdate instructions in containers.rst tree | commitdiff
2020-12-10 Berk HessA check for perturbed listed pairs beyond rlist tree | commitdiff
2020-12-09 Paul BauerFix indexing bug in electric field module tree | commitdiff
2020-12-09 Andrey AlekseenkoFix defining of EXCLUSION_FORCES in CUDA/OpenCL kernels tree | commitdiff
2020-12-07 Pascal MerzFix Nose-Hoover conserved energy tree | commitdiff
2020-12-02 Pascal MerzFix kinetic energy and temperatures reporting tree | commitdiff
2020-11-29 M. Eric IrrgangImprove accessibility of pytest documentation. tree | commitdiff
2020-11-26 Berk HessFix pull fatal error message tree | commitdiff
2020-11-25 Paul BauerFix error with links in docs tree | commitdiff
2020-11-24 Paul BauerMerge branch 'origin/release-2021' into merge-2021... tree | commitdiff
2020-11-24 Paul BauerMerge branch 'origin/release-2020' into merge-2020... tree | commitdiff
2020-11-24 Paul BauerFix gmx h2order -d option tree | commitdiff
2020-11-23 Paul BauerFixes for Intel and container build fixes tree | commitdiff
2020-11-18 M. Eric IrrgangReplace gmxapi `erroroutput` with `stderr` and `stdout` tree | commitdiff
2020-11-13 Gilles GouaillardetDetect ARM SVE Vector length if possible tree | commitdiff
2020-11-12 M. Eric IrrgangProvide common library headers through new CMake target. tree | commitdiff
2020-11-11 Paul BauerFix gmx do_dssp CHARMM support tree | commitdiff
2020-11-10 Berk HessFix dHdl and foreign energy clearing at checkpointing tree | commitdiff
2020-11-10 Pascal MerzFix MTTK constant energy bugs tree | commitdiff
2020-11-09 Joe JordanAdd backend for nblib listed forces API tree | commitdiff
2020-11-09 Paul BauerUse images from GitLab docker repository tree | commitdiff
2020-11-09 Berk HessMove implementation to cpp file tree | commitdiff
2020-11-05 Paul BauerAllow pdb2gmx to handle cyclic molecules tree | commitdiff
2020-11-05 Paul BauerMerge branch 'origin/release-2021' into merge-2021... tree | commitdiff
2020-11-05 Berk HessDisable MTS with SD integrator tree | commitdiff
2020-11-04 Alan GrayAllow GPU update without GPU DD tree | commitdiff
2020-11-04 Joe JordanNBLIB listed forces API update tree | commitdiff
2020-11-04 M. Eric IrrgangEstablish `api/` as the home for installed headers. tree | commitdiff
2020-10-28 Berk HessCorrect AWH initial histogram size tree | commitdiff
2020-10-27 M. Eric IrrgangUpdate image names in job definitions. tree | commitdiff
2020-10-26 Roland SchulzMake install-guide MPI consistent tree | commitdiff
2020-10-24 Paul BauerDisallow OpenMP on Windows in CI tree | commitdiff
2020-10-23 M. Eric IrrgangUpdate Docker image build scripts. tree | commitdiff
2020-10-23 Mark AbrahamMerge branch release-2021 tree | commitdiff
2020-10-22 Christian BlauChange outdated remdine references to gitlab tree | commitdiff
2020-10-22 Paul BauerPrepare master for 2022 tree | commitdiff
2020-10-21 Berk HessFix pull code bug with DD and atom sets tree | commitdiff
2020-10-21 Christian BlauClarify that mdtutorials are not provided by the gromac... tree | commitdiff
2020-10-20 Paul BauerMerge branch 'origin/release-2020' into merge-release... tree | commitdiff
2020-10-19 Paul BauerAdd release highlights tree | commitdiff
2020-10-19 Paul BauerRevert "Add muparser and CMake handling" tree | commitdiff
2020-10-19 Andrey AlekseenkoFix random doxygen warnings and typos tree | commitdiff
next
Local GROMACS mirror with custom stuff