#Machine-learning-potential
Showing 3 of 3 repositories tagged #machine-learning-potential, ranked by stars
deepmodeling
deepmd-kit
A deep learning package for many-body potential energy representation and molecular dynamics
Score
100
★ 2.0k
⑂ 629
—
Python
brucefan1983
GPUMD
Graphics Processing Units Molecular Dynamics
Score
50
★ 807
⑂ 194
+4/day
Cuda
dralgroup
mlatom
AI-enhanced computational chemistry
Score
0
★ 151
⑂ 21
—
Python