PG-PuReMD: backport missing valence angle correction from sPuReMD. (20ece267) · Commits · SParTA / PuReMD · GitLab

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20ece267

Commit 20ece267 authored 4 years ago by Kurt A. O'Hearn

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PG-PuReMD: backport missing valence angle correction from sPuReMD.

parent 5f6a651b

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PG-PuReMD/src/cuda/cuda_valence_angles.cu 1 addition, 1 deletion

PG-PuReMD/src/cuda/cuda_valence_angles.cu
PG-PuReMD/src/nonbonded.c 1 addition, 1 deletion

PG-PuReMD/src/nonbonded.c
PG-PuReMD/src/valence_angles.c 244 additions, 242 deletions

PG-PuReMD/src/valence_angles.c
sPuReMD/src/nonbonded.c 3 additions, 3 deletions

sPuReMD/src/nonbonded.c
sPuReMD/src/valence_angles.c 7 additions, 7 deletions

sPuReMD/src/valence_angles.c

with 256 additions and 254 deletions

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