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SYCL: Avoid using no_init read accessor in rocFFT
[alexxy/gromacs.git] / src / gromacs / nbnxm / nbnxm.h
2021-11-03 Andrey AlekseenkoFix random typos commit | commitdiff
2021-10-18 Andrey AlekseenkoMerge release-2021 into master commit | commitdiff
2021-09-29 Magnus LundborgSIMD support for nonbonded free-energy kernels commit | commitdiff
2021-09-14 Andrey AlekseenkoMerge remote-tracking branch 'origin/release-2021'... commit | commitdiff
2021-08-19 Andrey AlekseenkoMerge remote-tracking branch 'origin/release-2021'... commit | commitdiff
2021-06-29 Paul BauerMerge branch release-2021 into master commit | commitdiff
2021-06-04 Mark AbrahamConvert atomInfo to int64_t commit | commitdiff
2021-05-27 Artem ZhmurovRename GpuBonded into ListedForcesGpu commit | commitdiff
2021-05-26 ejjordanRemove foreign energy groups from gmx_enerdata_t commit | commitdiff
2021-05-24 Joe JordanRemove forcerec from dispatchFreeEnergyKernel signature commit | commitdiff
2021-05-20 Artem ZhmurovUse MessageStringCollector class to construct error... commit | commitdiff
2021-05-14 Artem ZhmurovRemove extra device force getter from NBNXM commit | commitdiff
2021-05-07 Paul BauerMerge branch release-2021 into merge-2021-into-master commit | commitdiff
2021-05-05 Joe JordanPass ArrayRefs to dispatchNonbondedKernel commit | commitdiff
2021-03-30 kanduriTurn t_forcerec.shift_vec into an std::vector of gmx... commit | commitdiff
2021-03-26 Joe JordanUse ArrayRefs instead of mdatoms in gmx_nb_free_energy_... commit | commitdiff
2021-03-25 ejjordanArrayRef and const ref in gmx_nb_free_energy_kernel commit | commitdiff
2021-03-17 Andrey AlekseenkoUse DeviceBuffer in GPU update and NBNXM code commit | commitdiff
2021-03-10 Joe JordanRemove param fillLocal, which was always false, from... commit | commitdiff
2021-03-10 Andrey AlekseenkoRevert "Wrap more device pointers in DeviceBuffer"... commit | commitdiff
2021-03-10 Andrey AlekseenkoWrap more device pointers in DeviceBuffer commit | commitdiff
2021-03-05 Paul BauerMerge branch release-2020 into merge-2020-into-2021 commit | commitdiff
2021-02-19 Joe JordanUse const refs in init_nb_verlet commit | commitdiff
2021-02-17 Artem ZhmurovUse GpuEventSynchronizer in NBNXM commit | commitdiff
2021-02-12 Mark AbrahamMerge branch release-2021 into master commit | commitdiff
2021-02-10 Andrey AlekseenkoFix clang-tidy-11 errors in NBNXM module, part 1 commit | commitdiff
2021-02-04 Artem ZhmurovMake LJ combination rule enum into an enum class commit | commitdiff
2021-01-29 Mark AbrahamMerge branch release-2021 commit | commitdiff
2021-01-07 Paul BauerMerge branch release-2020 into merge-2020-into-2021 commit | commitdiff
2020-12-18 Mark AbrahamMerge branch release-2021 commit | commitdiff
2020-11-24 Paul BauerMerge branch 'origin/release-2021' into merge-2021... commit | commitdiff
2020-11-24 Paul BauerMerge branch 'origin/release-2020' into merge-2020... commit | commitdiff
2020-11-11 Andrey AlekseenkoMake eelType and evdwType scoped enums, + cleanup commit | commitdiff
2020-10-20 Paul BauerMerge branch 'origin/release-2020' into merge-release... commit | commitdiff
2020-10-07 Paul BauerMerge branch 'origin/release-2020' into merge-release... commit | commitdiff
2020-09-29 Alan GrayRedevelopment of GPU Force Reduction/Buffer Ops commit | commitdiff
2020-08-31 Paul BauerMerge branch 'release-2020' into master commit | commitdiff
2020-07-06 Berk HessMove foreign potential energy accumulation commit | commitdiff
2020-05-20 Berk HessRemove t_mdatoms from Nbnxm setAtomProperties() commit | commitdiff
2020-05-06 Paul BauerMerge branch 'origin/release-2020' into master commit | commitdiff
2020-03-25 Artem ZhmurovMake use of the DeviceStreamManager commit | commitdiff
2020-03-11 Artem ZhmurovTake over management of OpenCL context from PME and... commit | commitdiff
2020-03-04 Paul BauerMerge branch release-2020 into master commit | commitdiff
2020-02-28 Paul BauerMerge branch release-2019 into release-2020 commit | commitdiff
2020-02-06 Artem ZhmurovUse RVec instead of float for x, v and f device buffers commit | commitdiff
2020-02-06 Artem ZhmurovMove DeviceInfo into GPU traits commit | commitdiff
2020-02-05 Artem ZhmurovMove non-bonded initialization out of the forcerec commit | commitdiff
2020-02-01 Artem ZhmurovMerge "Merge branch origin/release-2020 into master" commit | commitdiff
2020-01-31 Szilárd PállRemove BufferOpsUseGpu enum commit | commitdiff
2020-01-28 Paul BauerMerge branch origin/release-2020 into master commit | commitdiff
2020-01-27 Mark AbrahamMake NbnxnGpu class with constructor commit | commitdiff
2020-01-16 Mark AbrahamMake nbnxm headers more self-contained commit | commitdiff
2020-01-13 Berk HessAvoid unnecessary exclusion generation in DD commit | commitdiff
2020-01-09 Mark AbrahamSplit lines with many copyright years commit | commitdiff
2020-01-08 Roland SchulzMerge release-2019 into release-2020 commit | commitdiff
2020-01-07 Paul BauerMerge branch origin/release-2020 into master commit | commitdiff
2020-01-07 Paul BauerMerge commit d30f2cb6 from release-2020 into master commit | commitdiff
2019-12-27 Paul BauerMerge origin/release-2019 into release-2020 commit | commitdiff
2019-12-16 Berk HessUse ListOfLists in gmx_mtop_t and gmx_localtop_t commit | commitdiff
2019-11-30 Paul BauerMerge origin/release-2020 into master commit | commitdiff
2019-11-29 Mark AbrahamMerge branch release-2019 into release-2020 commit | commitdiff
2019-11-27 Alan GrayEvent-based Dependency for GPU Force Halo Exchange commit | commitdiff
2019-11-26 Alan GrayBug fix for nonlocal D2H coordinate transfer synchroniz... commit | commitdiff
2019-11-20 Paul BauerMerge 'origin/release-2019' into release-2020 commit | commitdiff
2019-11-07 Paul BauerApply clang-format to source tree commit | commitdiff
2019-10-31 Alan GrayRemove dead code for nbnxm H2D coordinate copy event commit | commitdiff
2019-10-29 Paul BauerMerge branch 'release-2019' into master commit | commitdiff
2019-10-23 Berk HessMove locality.h from nbnxm to mdtypes commit | commitdiff
2019-10-23 Berk HessUse gmx::Range in Nbnxm gridding functions commit | commitdiff
2019-10-23 Berk HessExpand documentation for nbnxn_put_on_grid() commit | commitdiff
2019-10-15 Szilárd PállTrigger synchronizer when local forces are ready commit | commitdiff
2019-10-15 Szilárd PállLink GPU coordinate producer and consumer tasks commit | commitdiff
2019-10-13 Szilárd PállEnable StatePropagatorGpuData for force transfers commit | commitdiff
2019-10-10 Szilárd PállPass list of EventSynchronizers to GPU reduction commit | commitdiff
2019-10-08 Berk HessMake nbnxm a proper module commit | commitdiff
2019-10-01 Artem ZhmurovStatePropagatorDataGpu object to manage GPU forces... commit | commitdiff
2019-09-25 Szilárd PállMerge remote-tracking branch 'origin/release-2019' commit | commitdiff
2019-09-24 Paul BauerMerge branch release-2019 into master commit | commitdiff
2019-09-18 Szilárd PállSet up workload data structures commit | commitdiff
2019-09-18 Alan GrayGPU Force Halo Exchange commit | commitdiff
2019-09-16 Alan GrayGPU halo exchange commit | commitdiff
2019-09-11 Artem ZhmurovDecouple GPU force buffer management from buffer ops... commit | commitdiff
2019-09-11 Artem ZhmurovDecouple coordinates buffer management from buffer... commit | commitdiff
2019-09-09 Szilárd PállPass gmx::ForceFlags to CPU nbnxm dispatch code commit | commitdiff
2019-09-09 Szilárd PállPass the new gmx::ForceFlags to the nbnxm module commit | commitdiff
2019-08-22 Mark AbrahamMerge branch release-2019 commit | commitdiff
2019-08-20 Berk HessUse shiftForces in ForceOuputs commit | commitdiff
2019-08-15 Alan GrayPME reduction for CUDA F buffer operations commit | commitdiff
2019-08-01 Paul BauerMerge release-2019 into master commit | commitdiff
2019-07-31 Szilárd PállStore wcycle pointer in nonbonded_verlet_t commit | commitdiff
2019-07-31 Szilárd PállFixes for F buffer ops change commit | commitdiff
2019-07-19 Alan GrayF buffer operations in CUDA commit | commitdiff
2019-07-01 Szilárd PállRefactor tracking of GPU short-range work/skipping commit | commitdiff
2019-07-01 Alan GrayBug fix and simplification for CUDA X Buffer Ops commit | commitdiff
2019-06-30 Szilárd PállCreate dedicated subcounter for nonbonded FEP commit | commitdiff
2019-06-28 Szilárd PállSeparate CPU NB kernel and buffer clearing subcounters commit | commitdiff
2019-06-18 Berk HessMake forcerec const in dispatchNonbondedKernel() commit | commitdiff
2019-05-10 Alan GrayPosition buffer ops in CUDA commit | commitdiff
2019-04-18 Berk HessRemove charge groups from domdec and localtop commit | commitdiff
2019-04-17 Berk HessRemove group scheme search code commit | commitdiff
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