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Enhanced conformational sampling in Monte Carlo simulations of proteins: application to a constrained peptide.

A Monte Carlo simulation method for globular proteins, called extended-scaled-collective-variable (ESCV) Monte Carlo, is proposed. This method combines two Monte Carlo algorithms known as entropy-sampling and scaled-collective-variable algorithms. Entropy-sampling Monte Carlo is able to sample a lar...

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Detalles Bibliográficos
Autor Principal: Kidera, A
Formato: Artigo
Idioma:Inglês
Publicado: 1995
Assuntos:
Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC40907/
https://ncbi.nlm.nih.gov/pubmed/7568238
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