Throw on failure in gmx_file_rename
[alexxy/gromacs.git] / src / gromacs / mdlib / mdoutf.cpp
2021-10-27 Joe JordanThrow on failure in gmx_file_rename
2021-10-18 Andrey AlekseenkoMerge release-2021 into master
2021-09-25 Berk HessReplace DOMAINDECOMP macro by a renamed function
2021-09-14 Andrey AlekseenkoMerge remote-tracking branch 'origin/release-2021'...
2021-08-19 Andrey AlekseenkoMerge remote-tracking branch 'origin/release-2021'...
2021-06-29 Paul BauerMerge branch release-2021 into master
2021-06-07 Paul BauerUse enum class for checkpoint version
2021-05-19 Joe JordanClean up some headers in mdlib
2021-05-07 Paul BauerMerge branch release-2021 into merge-2021-into-master
2021-05-04 Paul BauerUse correct size for force vector in mdoutf
2021-04-14 Paul BauerModernize wallcycle counting
2021-04-12 Mark AbrahamImprove docs and naming for MdModulesNotifiers
2021-03-19 Paul BauerBulk change to const ref for mtop
2021-03-15 Dmitry MoskalchukFix build for Folding@home
2021-03-05 Paul BauerMerge branch release-2020 into merge-2020-into-2021
2021-02-23 Pascal MerzFix multi-sim checkpoint writing bug
2021-02-22 Paul BauerRefactor md_enums
2021-02-12 Mark AbrahamMerge branch release-2021 into master
2021-02-04 Mark AbrahamEnsure no UB in writing forces
2021-01-29 Mark AbrahamMerge branch release-2021
2021-01-07 Paul BauerMerge branch release-2020 into merge-2020-into-2021
2020-12-18 Mark AbrahamMerge branch release-2021
2020-12-16 M. Eric IrrgangApply re-formatting to C++ in src/ tree.
2020-11-24 Paul BauerMerge branch 'origin/release-2020' into merge-2020...
2020-10-20 Paul BauerMerge branch 'origin/release-2020' into merge-release...
2020-10-07 Paul BauerMerge branch 'origin/release-2020' into merge-release...
2020-09-29 Artem ZhmurovDon't use fah_fsync
2020-09-23 Pascal MerzAccess write checkpoint functionality directly
2020-09-06 Pascal MerzPrepare legacy checkpoint for modular simulator checkpo...
2020-09-03 Pascal MerzMake dd_collect_vec independent of t_state
2020-08-31 Paul BauerMerge branch 'release-2020' into master
2020-08-27 Berk HessAdd ForceBuffers class
2020-07-31 Mark AbrahamMove code to prepare for multisim class
2020-07-15 Mark AbrahamDivide default communicator from DD communicators
2020-05-06 Paul BauerMerge branch 'origin/release-2020' into master
2020-04-06 Pascal MerzMake global topology constant in mdoutf
2020-03-04 Paul BauerMerge "Merge branch release-2020 into master"
2020-03-04 Paul BauerMerge branch release-2020 into master
2020-02-28 Paul BauerMerge branch release-2019 into release-2020
2020-02-25 Magnus LundborgFix out of sync checkpoint files in simulations sharing...
2020-01-28 Paul BauerMerge branch origin/release-2020 into master
2020-01-09 Mark AbrahamSplit lines with many copyright years
2020-01-08 Roland SchulzMerge release-2019 into release-2020
2020-01-07 Paul BauerMerge branch origin/release-2020 into master
2020-01-07 Paul BauerMerge commit d30f2cb6 from release-2020 into master
2019-12-27 Paul BauerMerge origin/release-2019 into release-2020
2019-12-19 ejjordanChange some domdec data members to RVec or IVec
2019-11-29 Mark AbrahamMerge branch release-2019 into release-2020
2019-11-20 Paul BauerMerge 'origin/release-2019' into release-2020
2019-11-07 Paul BauerApply clang-format to source tree
2019-10-29 Paul BauerMerge branch 'release-2019' into master
2019-09-25 Szilárd PállMerge remote-tracking branch 'origin/release-2019'
2019-09-24 Paul BauerMerge branch release-2019 into master
2019-09-01 Christian BlauAdd checkpointing for MdModules
2019-08-22 Mark AbrahamMerge branch release-2019
2019-08-01 Paul BauerMerge release-2019 into master
2019-06-14 Paul BauerMerge branch release-2018 into release-2019
2019-05-25 Pascal MerzRemove dependence of mdoutf_write_to_trajectory_files...
2019-05-22 Mark AbrahamIntroduce tri-state enums for restarts
2019-04-02 Paul BauerRefactor gmx_group_t to SimulationAtomGroups
2019-03-07 Mark AbrahamEliminate mdlib/mdrun.h
2019-03-06 Mark AbrahamRevert "Eliminate mdlib/mdrun.h"
2019-03-06 Mark AbrahamEliminate mdlib/mdrun.h
2019-03-02 Mark AbrahamMerge branch release-2019
2019-02-20 Paul BauerMerge branch 'release-2019' into master
2019-02-11 Roland SchulzRemove EmptyArrayRef
2019-01-30 Mark AbrahamMerge remote branch release-2018 into release-2019
2019-01-23 Roland SchulzMerge release-2019 into master
2019-01-23 Roland SchulzMerge release-2018 into release-2019
2019-01-02 Mark AbrahamMerge branch release-2019
2018-12-31 Paul BauerMerge branch release-2018 into release-2019
2018-12-26 Kevin BoydFix small leaks in do_md cleanup
2018-12-18 Szilárd PállMerge release-2019 branch into master
2018-12-17 Paul BauerMerge branch release-2018 into release-2019
2018-12-10 Paul BauerUse more const references in topology code
2018-11-21 Paul BauerMerge branch release-2018 into release-2019
2018-10-26 Mark AbrahamMerge branch release-2018 into release-2019
2018-10-08 Mark AbrahamImplement PaddedVector
2018-09-28 Mark AbrahamMake some symbols in gmxpre-config.h always defined
2018-09-09 Paul BauerRemove macro for group type in topology
2018-08-29 Mark AbrahamMerge branch release-2018
2018-08-24 Mark AbrahamMerge branch release-2018
2018-08-08 Roland SchulzRemove gmx custom fixed int (e.g. gmx_int64_t) types
2018-07-04 Roland SchulzMerge release-2018 into master
2018-06-04 Magnus LundborgWrite lambdas and box to TNG at correct intervals
2018-05-23 Berk HessSplit off collect.cpp from domdec.cpp
2018-05-03 Mark AbrahamMerge branch release-2018
2018-04-13 Mark AbrahamMerge branch release-2018
2018-03-28 Mark AbrahamMerge branch release-2018
2018-03-20 Mark AbrahamMerge branch release-2016 into release-2018
2018-03-13 Mark AbrahamAdd more const to uses of t_commrec and t_inputrec
2018-03-06 Mark AbrahamMerge branch release-2018
2018-02-27 Aleksei IupinovMerge branch 'release-2018'
2018-02-16 Mark AbrahamMerge branch release-2016 into release-2018
2018-02-16 Mark AbrahamMerge branch release-2018 into master
2018-02-14 Mark AbrahamMerge branch release-2016 into release-2018
2018-02-09 Mark AbrahamMerge branch release-2018
2018-02-08 Mark AbrahamMerge branch release-2016 into release-2018
2018-02-08 Aleksei IupinovMerge branch 'release-2018' into master
2018-02-06 Aleksei IupinovRemove unnecessary includes from domdec.h
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