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Data-driven molecular modeling with the generalized Langevin equation.
Francesca Grogan
Huan Lei
Xiantao Li
Nathan A. Baker
Published in:
J. Comput. Phys. (2020)
Keyphrases
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data driven
model driven
database
databases
real world
learning algorithm
genetic algorithm
three dimensional
evolutionary algorithm
modeling language
numerical methods
modeling method
drug discovery