PG-PuReMD: fix out-of-bounds mmeory accesses and unitialized data usage in...
PG-PuReMD: fix out-of-bounds mmeory accesses and unitialized data usage in energy and force tabulation routines for van der Waals and Coulomb interactions.
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- PG-PuReMD/src/allocate.c 1 addition, 0 deletionsPG-PuReMD/src/allocate.c
- PG-PuReMD/src/cuda/cuda_init_md.cu 1 addition, 1 deletionPG-PuReMD/src/cuda/cuda_init_md.cu
- PG-PuReMD/src/driver.c 3 additions, 3 deletionsPG-PuReMD/src/driver.c
- PG-PuReMD/src/forces.c 3 additions, 13 deletionsPG-PuReMD/src/forces.c
- PG-PuReMD/src/init_md.c 4 additions, 4 deletionsPG-PuReMD/src/init_md.c
- PG-PuReMD/src/lookup.c 120 additions, 78 deletionsPG-PuReMD/src/lookup.c
- PG-PuReMD/src/lookup.h 13 additions, 1 deletionPG-PuReMD/src/lookup.h
- PG-PuReMD/src/nonbonded.c 24 additions, 41 deletionsPG-PuReMD/src/nonbonded.c
- PG-PuReMD/src/reax_types.h 12 additions, 11 deletionsPG-PuReMD/src/reax_types.h
- PG-PuReMD/src/restart.c 17 additions, 5 deletionsPG-PuReMD/src/restart.c
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