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en.wikipedia.org/wiki/GranularityPrivate View Precision and ambiguity. Coarse-grained materials or systems have fewer, larger discrete components than fine-grained materials or systems.. A coarse-grained description of a system regards large subcomponents.; A fine-grained description regards smaller components of which the larger ones are composed.; The concepts granularity, coarseness, and fineness are relative; and are used when ...
Evaluation of Essential Dynamics and Fixed-Length Coarse Graining for ... pubs.acs.org/doi/10.1021/acs.jpcb.3c08198Private View For multiscale modeling of biomolecules, reliable coarse-grained (CG) models can offer great potential to simulate larger temporal and spatial scales than traditional all-atom (AA) models. In this study, we explore the essential dynamics coarse graining (EDCG) and fixed-length coarse graining (FLCG) approaches for constructing highly coarse-grained models for multidomain proteins (MDPs), with ...
Energy renormalization for coarse-graining polymers having ... - Science www.science.org/doi/10.1126/sciadv.aav4683Private View Polymer glass-forming (GF) materials exhibit complex dynamic and mechanical properties that strongly depend on temperature due to the glass transition (), and assessing these properties using all-atomistic (AA) molecular dynamics (MD) simulations is inherently challenging because of their limitations of accessing extended time and length scales.. Multiscale modeling, such as coarse-grained (CG ...