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Accelerated Molecular Dynamics Applied to the Peptaibol Folding Problem

The use of enhanced sampling molecular dynamics simulations to facilitate the folding of proteins is a relatively new approach which has quickly gained momentum in recent years. Accelerated molecular dynamics (aMD) can elucidate the dynamic path from the unfolded state to the near-native state, “fla...

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Detalhes bibliográficos
Publicado no:Int J Mol Sci
Main Authors: Tyagi, Chetna, Marik, Tamás, Vágvölgyi, Csaba, Kredics, László, Ötvös, Ferenc
Formato: Artigo
Idioma:Inglês
Publicado em: MDPI 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6747184/
https://ncbi.nlm.nih.gov/pubmed/31480404
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms20174268
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