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Optimized parameter selection reveals trends in Markov state models for protein folding

As molecular dynamics simulations access increasingly longer time scales, complementary advances in the analysis of biomolecular time-series data are necessary. Markov state models offer a powerful framework for this analysis by describing a system’s states and the transitions between them. A recent...

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Detalhes bibliográficos
Publicado no:J Chem Phys
Main Authors: Husic, Brooke E., McGibbon, Robert T., Sultan, Mohammad M., Pande, Vijay S.
Formato: Artigo
Idioma:Inglês
Publicado em: AIP Publishing LLC 2016
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC5116026/
https://ncbi.nlm.nih.gov/pubmed/27875868
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.4967809
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