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Fixes for F buffer ops change
2019-07-31
Szilárd Páll
Fixes for F buffer ops change
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2019-07-31
Szilárd Páll
Move cycle counting into the GPU bonded module
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2019-07-31
Szilárd Páll
Report when development feature flags are used
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2019-07-31
Szilárd Páll
Move end of step GPU task launches to a function
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2019-07-25
Szilárd Páll
Only stop the CUDA profiler if there are devices
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2019-07-22
Szilárd Páll
Conditionally pin GPU-related grid data
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2019-07-11
Szilárd Páll
Use HostVector for Grid/GridSet data need on-GPU
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2019-07-08
Szilárd Páll
Eliminate a use of double precision in the GPU bonded...
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2019-07-04
Szilárd Páll
Bump latest CUDA + gcc in the pre-submit matrix
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2019-07-04
Szilárd Páll
Fix a -Wformat-truncation warning in tng
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2019-07-01
Szilárd Páll
Refactor tracking of GPU short-range work/skipping
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2019-06-30
Szilárd Páll
Create dedicated subcounter for nonbonded FEP
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2019-06-28
Szilárd Páll
Separate CPU NB kernel and buffer clearing subcounters
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2019-06-27
Szilárd Páll
Remove already resolved post-submit matrix TODO
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2019-06-24
Szilárd Páll
Only use AVX512 in own-FFTW if GROMACS also uses it
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2019-05-29
Szilárd Páll
Template x buffer ops call on whether GPU is used
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2019-05-23
Szilárd Páll
Fix mulitple link refs in dev-manual
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2019-05-20
Szilárd Páll
Improve X buffer ops kernel
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2019-04-25
Szilárd Páll
Fix clang warning about NULL use
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2019-04-25
Szilárd Páll
Avoid using AtomLocality::Count as a valid value
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2019-04-24
Szilárd Páll
Fix CUDA fallback shmem gather reduction
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2019-04-18
Szilárd Páll
Fix warnings & consolidate declarations
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2019-04-16
Szilárd Páll
Move functions operating on enerdata out of force.cpp
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2019-04-16
Szilárd Páll
Remove "coarse load balancing vars" from forcerec
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2019-04-16
Szilárd Páll
Group scheme related cleanup
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2019-04-16
Szilárd Páll
Remove Group scheme neighbor search wrapper
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2019-04-05
Szilárd Páll
Revert "Temporarily disable ARM HPC compiler in post...
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2019-04-02
Szilárd Páll
Temporarily disable ARM HPC compiler in post-submit
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2019-03-26
Szilárd Páll
Skip PBC calculation when there are no listed forces
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2019-03-26
Szilárd Páll
do_force_cutsVERLET cleanup
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2019-03-21
Szilárd Páll
Reorder PBC setup in do_force_lowlevel
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2019-03-13
Szilárd Páll
Reorganize search-time code in do_force_cutsVERLET
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2019-03-13
Szilárd Páll
Add haveGpuBondedWork flag to PpForceWorkload
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2019-03-13
Szilárd Páll
Start modularizing force workload setup
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2019-03-02
Szilárd Páll
Encapsulate force output setup in do_force_*
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2019-03-01
Szilárd Páll
Clarify force buffer setup code in do_force
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2019-02-17
Szilárd Páll
Improve GPU target compatibility error message
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2019-02-15
Szilárd Páll
Extend GpuEventSynchronizer to allow on-device sync
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2019-02-15
Szilárd Páll
Extend performance considerations on bonded offload
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2019-02-13
Szilárd Páll
Disable instruction fusion on Power8
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2019-02-13
Szilárd Páll
Minor refactoring in mdrunnner
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2019-02-12
Szilárd Páll
Minor refactor of gpuid / task mapping parsing
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2019-02-07
Szilárd Páll
Require a 64-bit platform for OpenCL
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2019-01-30
Szilárd Páll
Fix double-increment of GPU NB launch subcounter
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2019-01-21
Szilárd Páll
Add CUDA CC 7.5 (Turing) support with nvcc
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2019-01-04
Szilárd Páll
Fix formatting warning
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2019-01-02
Szilárd Páll
Fix clang 6 warning
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2019-01-02
Szilárd Páll
Do not whitelist the use of OpenCL 1.1 API
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2018-12-31
Szilárd Páll
Fix release notes typo
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2018-12-31
Szilárd Páll
Add CUDA CC 7.5 (Turing) support with nvcc
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2018-12-27
Szilárd Páll
Use std::swap in LINCS
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2018-12-22
Szilárd Páll
Runtime check of device OpenCL support
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2018-12-21
Szilárd Páll
Make jenkins own-fftw verify use local tarball
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2018-12-20
Szilárd Páll
Fix CUDA compiled target-device compatibility check
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2018-12-20
Szilárd Páll
Correct CUDA compatibility check
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2018-12-20
Szilárd Páll
Merge "Merge branch release-2018 into release-2019...
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2018-12-18
Szilárd Páll
Merge release-2019 branch into master
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2018-12-17
Szilárd Páll
Fix GMX_BUILD_OWN_FFTW_URL CMake cache entry type
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2018-12-14
Szilárd Páll
Enable ARMPL in the armclang build
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2018-12-13
Szilárd Páll
Avoid spurious timing in bonded GPU launch subcounter
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2018-12-13
Szilárd Páll
Document the FP exception in cuFFT 7.0
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2018-12-12
Szilárd Páll
Improve DLB report/note
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2018-12-11
Szilárd Páll
Tweak the bonded GPU energy copy/wait operations
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2018-12-06
Szilárd Páll
Add Bonded GPU launch overhead cycle subcounter
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2018-12-06
Szilárd Páll
Swap the order of GPU bonded and nonbonded launch
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2018-12-06
Szilárd Páll
Fix conditional in nonlocal nbnxn GPU work skipping
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2018-12-06
Szilárd Páll
Split nbnxn input copy and kernel launch
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2018-12-05
Szilárd Páll
Correct thread count in the PME GPU reduction
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2018-11-27
Szilárd Páll
Add ARMPL support to admin script
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2018-11-27
Szilárd Páll
Add tweaks to support ARMPL for FFTs
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2018-11-07
Szilárd Páll
Re-enable the armclang post-submit build
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2018-11-07
Szilárd Páll
Eliminate macro that expands to variable in PME GPU
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2018-11-07
Szilárd Páll
Ensure minimum exec width of the PME OpenCL kernels
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2018-10-14
Szilárd Páll
Fix more clang-6 warnings in CUDA code
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2018-10-14
Szilárd Páll
Modernize OpenCL memory allocation flags
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2018-10-10
Szilárd Páll
Swap custom OpenCL memset kernel for clEnqueueFillBuffer
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2018-10-09
Szilárd Páll
Update regressiontest ref to download
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2018-10-08
Szilárd Páll
Tweak FindFFTW API checks
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2018-10-08
Szilárd Páll
Fix clang-6 warnings
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2018-10-08
Szilárd Páll
Replace some NULL with nullptr in CUDA code
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2018-10-07
Szilárd Páll
Use new GPU slave for AMD OpenCL verify runs
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2018-10-05
Szilárd Páll
Update test matrices with new GPU specifiers
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2018-09-29
Szilárd Páll
Fix constraints cycle counting
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2018-09-21
Szilárd Páll
Bump test timeout only for OpenCL integration tests
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2018-08-28
Szilárd Páll
Quiet cmake about clFFT not found after first run
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2018-08-21
Szilárd Páll
Request flushing denorms to zero in OpenCL
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2018-08-20
Szilárd Páll
Disable single compilation unit with CUDA 9.0
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2018-08-15
Szilárd Páll
Improve GPU detection sanity check error message
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2018-07-30
Szilárd Páll
Move out OpenCL device utils from vectype ops
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2018-07-30
Szilárd Páll
Improve the robustness of the nvcc CMake check
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2018-07-30
Szilárd Páll
Fix nvcc host compiler check triggering
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2018-07-29
Szilárd Páll
Corrections to the user guide mdrun perf section
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2018-06-12
Szilárd Páll
Also issue OMP_NUM_THREADS reading note to the log
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2018-06-04
Szilárd Páll
Fix timing of clFFT kernels
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2018-05-29
Szilárd Páll
Switch to CUDA 9.2 + gcc 7
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2018-04-26
Szilárd Páll
Bump required CUDA version to 7.0
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2018-04-23
Szilárd Páll
Fix icc warning in post-submit
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2018-04-21
Szilárd Páll
Add post-submit with ARM HPC Toolchain
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2018-04-21
Szilárd Páll
Tweak PME run mode checks
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2018-04-20
Szilárd Páll
Minor fix for pre-submit matrix docs
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