PG-PuReMD: fix atomic force reductions and reduce the number of atomic operations. (74f5c1c6) · Commits · SParTA / PuReMD · GitLab

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74f5c1c6

Commit 74f5c1c6 authored 4 years ago by Kurt A. O'Hearn

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PG-PuReMD: fix atomic force reductions and reduce the number of atomic operations.

parent 7c451993

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PG-PuReMD/src/cuda/cuda_forces.cu 2 additions, 11 deletions

PG-PuReMD/src/cuda/cuda_forces.cu
PG-PuReMD/src/cuda/cuda_hydrogen_bonds.cu 20 additions, 45 deletions

PG-PuReMD/src/cuda/cuda_hydrogen_bonds.cu
PG-PuReMD/src/cuda/cuda_multi_body.cu 0 additions, 54 deletions

PG-PuReMD/src/cuda/cuda_multi_body.cu
PG-PuReMD/src/cuda/cuda_nonbonded.cu 144 additions, 178 deletions

PG-PuReMD/src/cuda/cuda_nonbonded.cu
PG-PuReMD/src/cuda/cuda_nonbonded.h 2 additions, 2 deletions

PG-PuReMD/src/cuda/cuda_nonbonded.h
PG-PuReMD/src/cuda/cuda_torsion_angles.cu 16 additions, 14 deletions

PG-PuReMD/src/cuda/cuda_torsion_angles.cu
PG-PuReMD/src/cuda/cuda_valence_angles.cu 8 additions, 5 deletions

PG-PuReMD/src/cuda/cuda_valence_angles.cu

with 192 additions and 309 deletions

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