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Improvements in Markov State Model Construction Reveal Many Non-Native Interactions in the Folding of NTL9

Markov State Models (MSMs) provide an automated framework to investigate the dynamical properties of high-dimensional molecular simulations. These models can provide a human-comprehensible picture of the underlying process, and have been successfully used to study protein folding, protein aggregatio...

Ausführliche Beschreibung

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Bibliographische Detailangaben
Hauptverfasser: Schwantes, Christian R., Pande, Vijay S.
Format: Artigo
Sprache:Inglês
Veröffentlicht: 2013
Schlagworte:
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC3673732/
https://ncbi.nlm.nih.gov/pubmed/23750122
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ct300878a
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