Slicing and Dicing: Optimal Coarse-Grained Representation to Preserve Molecular Kinetics
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DOI: 10.1021/acscentsci.2c01200
Abstract: The aim of molecular coarse-graining approaches is to recover relevant physical properties of the molecular system via a lower-resolution model that can be more efficiently simulated. Ideally, the lower resolution still accounts for the degrees… read more here.
Keywords: dicing optimal; coarse graining; degrees freedom; slicing dicing ... See more keywords