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Avoid division by zero is pruning part calculation
2017-08-29
Szilárd Páll
Avoid division by zero is pruning part calculation
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2017-08-21
Szilárd Páll
Add OpenCL pruning kernels and launch/timing logic
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2017-08-18
Szilárd Páll
Improve awkward handling of GMX_CUDA_TARGET* help
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2017-08-18
Szilárd Páll
Add CUDA pruning kernels and launch/timing logic
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2017-07-27
Szilárd Páll
Inform users about the end of run DLB state
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2017-06-26
Szilárd Páll
Add ARM_NEON_ASIMD post-submit test
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2017-06-21
Szilárd Páll
Re-enable lost DD warning + minor code modernization
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2017-06-20
Szilárd Páll
Re-enable accidentally lost DD warning
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2017-06-20
Szilárd Páll
Refactoring + clarification of DLB state handling
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2017-06-15
Szilárd Páll
Allow disabling the explicit use of CUDA textures
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2017-06-07
Szilárd Páll
Suppress sm_2x deprecation warning with CUDA 8.0
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2017-06-05
Szilárd Páll
Add CUDA 8.0 + SIMD pre-submit test
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2017-06-02
Szilárd Páll
Add ARM_NEON post-submit test
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2017-05-29
Szilárd Páll
Quotes are cool, typo-free ones are even "cooler"
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2017-05-23
Szilárd Páll
Add basic doxygen for the Verlet nonbonded module
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2017-03-29
Szilárd Páll
Refactor CUDA kernel use of tables
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2017-03-29
Szilárd Páll
Add CUDA util function for constant loads
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2017-03-25
Szilárd Páll
Conditional tweak in the nonbonded GPU kernels
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2017-03-17
Szilárd Páll
Allow bypassing OpenCL device compatibility check
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2017-03-16
Szilárd Páll
Print code of unknown OpenCL error
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2017-03-09
Szilárd Páll
Fix mdrun hanging upon exit with sep PME ranks
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2017-01-24
Szilárd Páll
Remove unused argument in GPU kernels
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2016-12-09
Szilárd Páll
Turn off hwloc support when static lib found
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2016-11-17
Szilárd Páll
Correct kernel launch bounds for CUDA sm_60
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2016-11-01
Szilárd Páll
Merge "Merge branch release-2016"
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2016-10-28
Szilárd Páll
GPU-related additions to the install/user guide
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2016-10-27
Szilárd Páll
Make -cl-fast-relaxed-math default
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2016-10-26
Szilárd Páll
Add GMX_DISABLE_GPU_TIMING env var
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2016-10-09
Szilárd Páll
Correct kernel launch bounds for CUDA sm_60
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2016-08-27
Szilárd Páll
Make ASAN/TSAN/MSAN build types easier to discover
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2016-07-08
Szilárd Páll
Add PDF metadata to the manual
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2016-07-08
Szilárd Páll
User guide clarifications
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2016-07-07
Szilárd Páll
Add user guide info on CUDA application clocks
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2016-07-05
Szilárd Páll
Document GMX_GPU_APPLICATION_CLOCKS
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2016-07-04
Szilárd Páll
Disable NVIDIA JIT cache with OpenCL
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2016-06-14
Szilárd Páll
Fix CUDA build with multiple compilation units
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2016-06-05
Szilárd Páll
Add support for CUDA CC 6.0/6.1
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2016-06-02
Szilárd Páll
Add env. var. to enable OpenCL caching
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2016-06-02
Szilárd Páll
Fix OpenCL binary cache file name generation
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2016-05-05
Szilárd Páll
Remove CUDA host compiler consistency checks
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2016-04-28
Szilárd Páll
Workaround for gcc false positive warning
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2016-04-27
Szilárd Páll
Fix multiple MPI ranks per node with OpenCL
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2016-04-26
Szilárd Páll
Fix OpenCL assertion
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2016-04-19
Szilárd Páll
Move out CUDA profiler triggers from NBNXN
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2016-04-13
Szilárd Páll
Spelling fixes
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2016-04-13
Szilárd Páll
Do not create empty man/man7 directory
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2016-04-04
Szilárd Páll
Mark more variables as advanced
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2016-03-31
Szilárd Páll
refactor CUDA texture-based table initialization
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2016-03-31
Szilard Pall
avoid CPU oversubscription with GPUs
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2016-03-31
Szilárd Páll
Fix multiple tMPI ranks per OpenCL device
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2016-03-30
Szilárd Páll
LJ combination rule kernels for OpenCL
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2016-03-30
Szilárd Páll
Re-enable i-atom type local mem prefetch in OpenCL
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2016-03-30
Szilárd Páll
Describe AMD APPSDK 3.0 issues in the guide
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2016-03-17
Szilárd Páll
Fixed OpenCL e/fshift clear kernel first invocation
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2016-02-26
Szilárd Páll
Fix leftover load() calls in the simd util headers
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2016-02-19
Szilárd Páll
Fix OpenCL table interpolations of Ewald correction
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2016-02-17
Szilárd Páll
reintroduce supercl interaction mask constant
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2016-02-17
Szilárd Páll
change macros to constants in GPU code
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2016-02-15
Szilárd Páll
Allow GMX_NB_MIN_CI=0 to be passed
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2016-02-11
Szilárd Páll
Re-enable LJ-PME + Lorentz-Berthelot on GPUs
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2016-02-08
Szilárd Páll
Handle uniformly GMX_OCL_NOGENCACHE
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2016-02-06
Szilard Pall
Use cudaLaunchKernel with CUDA 7.0 and later
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2016-01-26
Szilárd Páll
GPU code reorganization and tweaks
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2016-01-20
Szilárd Páll
Merge remote-tracking branch 'origin/release-5-1' into...
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2016-01-05
Szilard Pall
remove duplicate macros and enable Wundef in CUDA
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2016-01-01
Szilard Pall
Fix xlc+CUDA workaround in gmxManageNvccConfig
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2015-12-26
Szilard Pall
Improve documentation on OpenCL issue with NVIDIA
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2015-12-13
Szilard Pall
OpenCL code cleanup
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2015-11-04
Szilard Pall
Tweak NVML-related messages
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2015-11-02
Szilard Pall
Fix signal type
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2015-11-01
Szilard Pall
Fix bug in cycle subcounter management
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2015-10-24
Szilard Pall
Avoid using incompatible NVML version
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2015-10-22
Szilard Pall
Quiet FindNVML
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2015-10-15
Szilárd Páll
Add CUDA nvcc >=7.0 support
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2015-10-15
Szilárd Páll
Correct CUDA version comparisons
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2015-10-15
Szilard Pall
Fix reset error message
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2015-09-27
Szilard Pall
Tweak the CUDA GPU shared mem/L1 config
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2015-09-17
Szilard Pall
Fix broken OpenCL detection
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2015-09-16
Szilard Pall
Fix OpenCL build
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2015-08-13
Szilard Pall
add clFlush to kick of OpenCL work
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2015-07-02
Szilard Pall
Fix OpenCL compilation errors.
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2015-06-29
Szilard Pall
Fix CUDA inter-stream synchronization issue
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2015-06-27
Szilard Pall
Fix CUDA architecture dependent issues
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2015-06-25
Szilard Pall
Add missing macro undef in CUDA NB kernel
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2015-06-21
Szilard Pall
fix CPU core oversubscription detection
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2015-06-17
Szilard Pall
fix minor CUDA NB kernel performance regression
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2015-06-08
Szilard Pall
add last two GROMACS paper citations
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2015-06-06
Szilard Pall
Optimize atomic accumulation in CUDA NB kernel
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2015-05-15
Szilard Pall
Assert the size of non-bonded GPU work units
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2015-05-14
Szilard Pall
Merge release-4-6 into release-5-0
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2015-05-13
Szilard Pall
Fix auto-downloaded regression test execution
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2015-05-06
Szilárd Páll
Merge "Merge release-4-6 into release-5-0" into release-5-0
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2015-01-16
Szilard Pall
Improve and clarify mdrun behavior with nsteps<0
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2014-12-10
Szilard Pall
Fix nstep command line override print
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2014-06-01
Szilárd Páll
Add quote on the kT-kj/mol conversion factor
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2014-03-11
Szilárd Páll
Bump required CUDA version to 4.0
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2014-03-01
Szilard Pall
Added CUDA LJ-PME nbnxn kernels
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2014-02-28
Szilard Pall
Improved CUDA non-bonded kernel performance
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2014-02-27
Szilard Pall
CUDA kernels for switched LJ
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2014-02-21
Szilard Pall
portability aspects in install guide + minor tweaks
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