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Enhanced modeling via network theory: Adaptive sampling of Markov state models

Computer simulations can complement experiments by providing insight into molecular kinetics with atomic resolution. Unfortunately, even the most powerful supercomputers can only simulate small systems for short timescales, leaving modeling of most biologically relevant systems and timescales intrac...

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Bibliografski detalji
Glavni autori: Bowman, Gregory R., Ensign, Daniel L., Pande, Vijay S.
Format: Artigo
Jezik:Inglês
Izdano: 2010
Teme:
Online pristup:https://ncbi.nlm.nih.gov/pmc/articles/PMC3637129/
https://ncbi.nlm.nih.gov/pubmed/23626502
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