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Multiple Simulated Annealing-Molecular Dynamics (MSA-MD) for Conformational Space Search of Peptide and Miniprotein

Protein and peptide structure predictions are of paramount importance for understanding their functions, as well as the interactions with other molecules. However, the use of molecular simulation techniques to directly predict the peptide structure from the primary amino acid sequence is always hind...

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Detalhes bibliográficos
Publicado no:Sci Rep
Main Authors: Hao, Ge-Fei, Xu, Wei-Fang, Yang, Sheng-Gang, Yang, Guang-Fu
Formato: Artigo
Idioma:Inglês
Publicado em: Nature Publishing Group 2015
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC4616061/
https://ncbi.nlm.nih.gov/pubmed/26492886
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/srep15568
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