Convert atomInfo to int64_t
[alexxy/gromacs.git] / src / gromacs / nbnxm / atomdata.h
2021-06-04 Mark AbrahamConvert atomInfo to int64_t
2021-05-07 Paul BauerMerge branch release-2021 into merge-2021-into-master
2021-04-27 ejjordanRemove leftover function declaration from nbnxm atomdata
2021-04-27 Joe JordanUnify constructor of nbnxn_atomdata_t
2021-04-12 Joe JordanReplace defines with constexpr in ishift
2021-03-30 kanduriTurn t_forcerec.shift_vec into an std::vector of gmx...
2021-03-10 Joe JordanRemove param fillLocal, which was always false, from...
2021-03-05 Paul BauerMerge branch release-2020 into merge-2020-into-2021
2021-02-12 Mark AbrahamMerge branch release-2021 into master
2021-02-10 Andrey AlekseenkoFix clang-tidy-11 errors in NBNXM module, part 1
2021-02-09 Mark AbrahamRemove tree-reduce algorithm
2021-02-04 Artem ZhmurovMake LJ combination rule enum into an enum class
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
2020-11-24 Paul BauerMerge branch 'origin/release-2021' into merge-2021...
2020-11-24 Paul BauerMerge branch 'origin/release-2020' into merge-2020...
2020-11-11 Andrey AlekseenkoMake eelType and evdwType scoped enums, + cleanup
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 Alan GrayRedevelopment of GPU Force Reduction/Buffer Ops
2020-08-31 Paul BauerMerge branch 'release-2020' into master
2020-06-08 Kevin BoydReplace nbnxn_buffer_flags_t with vector
2020-05-20 Berk HessRemove t_mdatoms from Nbnxm setAtomProperties()
2020-05-06 Paul BauerMerge branch 'origin/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
2020-02-06 Artem ZhmurovUse RVec instead of float for x, v and f device buffers
2020-01-28 Paul BauerMerge branch origin/release-2020 into master
2020-01-27 Mark AbrahamMake NbnxnGpu class with constructor
2020-01-17 Mark AbrahamRegularize nbnxm module doxygen
2020-01-16 Mark AbrahamMake nbnxm headers more self-contained
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
2019-12-12 Paul BauerMerge branch 'origin/release-2020' into master
2019-11-30 Paul BauerMerge origin/release-2020 into master
2019-11-29 Mark AbrahamMerge branch release-2019 into release-2020
2019-11-21 Mark AbrahamMerge branch release-2020
2019-11-20 Paul BauerMerge 'origin/release-2019' into release-2020
2019-11-14 Berk HessSimplify t_forcerec destruction
2019-11-07 Paul BauerApply clang-format to source tree
2019-10-29 Paul BauerMerge branch 'release-2019' into master
2019-10-23 Berk HessMove locality.h from nbnxm to mdtypes
2019-10-15 Szilárd PállLink GPU coordinate producer and consumer tasks
2019-10-10 Szilárd PállPass list of EventSynchronizers to GPU reduction
2019-10-01 Artem ZhmurovStatePropagatorDataGpu object to manage GPU forces...
2019-09-25 Szilárd PállMerge remote-tracking branch 'origin/release-2019'
2019-09-24 Paul BauerMerge branch release-2019 into master
2019-09-11 Artem ZhmurovDecouple GPU force buffer management from buffer ops...
2019-09-11 Artem ZhmurovDecouple coordinates buffer management from buffer...
2019-08-22 Mark AbrahamMerge branch release-2019
2019-08-20 Berk HessUse shiftForces in ForceOuputs
2019-08-15 Alan GrayPME reduction for CUDA F buffer operations
2019-08-01 Paul BauerMerge release-2019 into master
2019-07-19 Alan GrayF buffer operations in CUDA
2019-05-29 Szilárd PállTemplate x buffer ops call on whether GPU is used
2019-05-10 Alan GrayPosition buffer ops in CUDA
2019-03-19 Berk HessReduce dependencies of nbnxn_atomdata_t
2019-03-15 Berk HessChange nbnxn_search to class PairSearch
2019-03-12 Berk HessMove nbnxm atom macros to atomdata.h
2019-03-05 Berk HessMove nbnxm atomdata types to atomdata.h
2019-03-02 Mark AbrahamMerge branch release-2019
2019-02-23 Berk HessHide internals of nbnxm parlist
2019-02-21 Berk HessClean up nbnxm enums
2019-02-20 Paul BauerMerge branch 'release-2019' into master
2019-02-17 Berk HessUse enum class for nbnxm locality
2019-02-16 Berk HessMove nbnxn files to nbnxm directory