FSATOOL 2.0: An integrated molecular dynamics simulation and trajectory data analysis program.

Zirui Shu Mincong Wu Jun Liao Changjun Chen

Published in: J. Comput. Chem. (2022)

Keyphrases

molecular dynamics
data analysis
molecular dynamics simulations
scientific data
high performance computing
protein folding
data collection
data mining
fluid flow
machine learning
power consumption
mathematical models