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Using generalized ensemble simulations and Markov state models to identify conformational states

Part of understanding a molecule’s conformational dynamics is mapping out the dominant metastable, or long lived, states that it occupies. Once identified, the rates for transitioning between these states may then be determined in order to create a complete model of the system’s conformational dynam...

Täydet tiedot

Tallennettuna:
Bibliografiset tiedot
Päätekijät: Bowman, Gregory R., Huang, Xuhui, Pande, Vijay S.
Aineistotyyppi: Artigo
Kieli:Inglês
Julkaistu: 2009
Aiheet:
Linkit:https://ncbi.nlm.nih.gov/pmc/articles/PMC2753735/
https://ncbi.nlm.nih.gov/pubmed/19410002
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.ymeth.2009.04.013
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