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Markov State Model Reveals Folding and Functional Dynamics in Ultra-Long MD Trajectories
Two strategies have been recently employed to push molecular simulation to long, biologically relevant timescales: projection-based analysis of results from specialized hardware producing a small number of ultra-long trajectories and the statistical interpretation of massive parallel sampling perfor...
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| Main Authors: | , , , , |
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| פורמט: | Artigo |
| שפה: | Inglês |
| יצא לאור: |
2011
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| נושאים: | |
| גישה מקוונת: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3227799/ https://ncbi.nlm.nih.gov/pubmed/21988563 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ja207470h |
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