search

GOMC-WSU / GOMC

GOMC - GPU Optimized Monte Carlo is a parallel molecular simulation code designed for high-performance simulation of large systems
https://gomc-wsu.org
MIT License
76 stars 36 forks source link

Single Molecule Displacement and Rotation Transform Kernels #437

Closed GregorySchwing closed 2 years ago

GregorySchwing commented 2 years ago

Setup the cpu to use r123, so the GPU and CPU agree for Single molecule Displacement and Rotation transforms and energy.