Data-driven molecular modeling with the generalized Langevin equation

Published 2020 View Full Article

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Title
Data-driven molecular modeling with the generalized Langevin equation
Authors
Keywords
Molecular dynamics, Generalized Langevin equation, Coarse-grained models, Dimension reduction, Data-driven parametrization
Journal
JOURNAL OF COMPUTATIONAL PHYSICS
Volume 418, Issue -, Pages 109633
Publisher
Elsevier BV
Online
2020-06-03
DOI
10.1016/j.jcp.2020.109633

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