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DMD: An Efficient And Versatile Simulation Method For Fine Protein Characterization

Until now it has been impractical to observe protein folding in silico for proteins larger than 50 residues. Limitations of both force field accuracy and computational efficiency make the folding problem very challenging. Here we employ discrete molecular dynamics (DMD) simulations with an all-atom...

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Detalhes bibliográficos
Main Authors: Shirvanyants, David, Ding, Feng, Tsao, Douglas, Ramachandran, Srinivas, Dokholyan, Nikolay V.
Formato: Artigo
Idioma:Inglês
Publicado em: 2012
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3406226/
https://ncbi.nlm.nih.gov/pubmed/22280505
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp2114576
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