MDIL-SNU

Pinned Repositories

AMP2
Language:Python20 3 110
G-metaD
Metadynamics code on the G-space.
Language:C++13 2 14
SevenNet
SevenNet - a graph neural network interatomic potential package supporting efficient multi-GPU parallel molecular dynamics simulations.
Language:Python105 4 1713
SHERPA
Language:C00
SIMPLE-NN
SIMPLE-NN(SNU Interatomic Machine-learning PotentiaL packagE – version Neural Network)
Language:Python47 12 3023
SIMPLE-NN_v2
Language:C++39 5 1317
SPINNER
SPINNER (Structure Prediction of Inorganic crystals using Neural Network potentials with Evolutionary and Random searches)
Language:C++12 1 12
TL-GeoCGNN
Language:Python0 0 00
utility
Lab utility
Language:Python1 3 01

MDIL-SNU's Repositories

MDIL-SNU/SevenNet
SevenNet - a graph neural network interatomic potential package supporting efficient multi-GPU parallel molecular dynamics simulations.
Language:Python105 4 1713
MDIL-SNU/SIMPLE-NN
SIMPLE-NN(SNU Interatomic Machine-learning PotentiaL packagE – version Neural Network)
Language:Python47 12 3023
MDIL-SNU/SIMPLE-NN_v2
Language:C++39 5 1317
MDIL-SNU/AMP2
Language:Python20 3 110
MDIL-SNU/G-metaD
Metadynamics code on the G-space.
Language:C++13 2 14
MDIL-SNU/SPINNER
SPINNER (Structure Prediction of Inorganic crystals using Neural Network potentials with Evolutionary and Random searches)
Language:C++12 1 12
MDIL-SNU/utility
Lab utility
Language:Python1 3 01
MDIL-SNU/SHERPA
Language:C00
MDIL-SNU/TL-GeoCGNN
Language:Python0 0 00