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Sarkas: A fast pure-python molecular dynamics suite for plasma physics.
Luciano G. Silvestri
Lucas J. Stanek
Gautham Dharuman
Yongjun Choi
Michael S. Murillo
Published in:
Comput. Phys. Commun. (2022)
Keyphrases
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molecular dynamics
high performance computing
molecular dynamics simulations
open source
scientific data
protein folding
artificial intelligence
fluid flow
active learning
motion estimation
data management
theoretical analysis
computing systems
parallel computing