Development of accurate coarse-grained force fields for weakly polar groups by an indirect parameterization strategy

Coarse-grained (CG) molecular dynamics simulations are widely used to predict morphological structures and interpret mechanisms of mesoscopic behavior between the scope of traditional experiments and all-atom simulations. However, most current CG force fields (FFs) are not precise enough, especially...

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Veröffentlicht in:Physical chemistry chemical physics : PCCP 2021-03, Vol.23 (11), p.6763-6774
Hauptverfasser: Song, Junjie, Wan, Mingwei, Yang, Ying, Gao, Lianghui, Fang, Weihai
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Sprache:eng
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