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Perspective: Markov models for long-timescale biomolecular dynamics

Molecular dynamics simulations have the potential to provide atomic-level detail and insight to important questions in chemical physics that cannot be observed in typical experiments. However, simply generating a long trajectory is insufficient, as researchers must be able to transform the data in a...

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Autori principali: Schwantes, C. R., McGibbon, R. T., Pande, V. S.
Natura: Artigo
Lingua:Inglês
Pubblicazione: American Institute of Physics 2014
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Accesso online:https://ncbi.nlm.nih.gov/pmc/articles/PMC4156582/
https://ncbi.nlm.nih.gov/pubmed/25194354
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.4895044
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