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Coarse-Grained Peptide Modeling Using a Systematic Multiscale Approach

A systematic new approach to derive multiscale coarse-grained (MS-CG) models has been recently developed. The approach employs information from atomistically detailed simulations to derive CG forces and associated effective potentials. In this work, the MS-CG methodology is extended to study two pep...

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Détails bibliographiques
Auteurs principaux: Zhou, Jian, Thorpe, Ian F., Izvekov, Sergey, Voth, Gregory A.
Format: Artigo
Langue:Inglês
Publié: Biophysical Society 2007
Sujets:
Accès en ligne:https://ncbi.nlm.nih.gov/pmc/articles/PMC1877786/
https://ncbi.nlm.nih.gov/pubmed/17400700
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1529/biophysj.106.094425
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