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Advances in Molecular Dynamics Simulations and Enhanced Sampling Methods for the Study of Protein Systems

Molecular dynamics (MD) simulation is a rigorous theoretical tool that when used efficiently could provide reliable answers to questions pertaining to the structure-function relationship of proteins. Data collated from protein dynamics can be translated into useful statistics that can be exploited t...

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Detalhes bibliográficos
Publicado no:Int J Mol Sci
Main Authors: Lazim, Raudah, Suh, Donghyuk, Choi, Sun
Formato: Artigo
Idioma:Inglês
Publicado em: MDPI 2020
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC7504087/
https://ncbi.nlm.nih.gov/pubmed/32882859
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms21176339
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