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Linking time-series of single-molecule experiments with molecular dynamics simulations by machine learning

Single-molecule experiments and molecular dynamics (MD) simulations are indispensable tools for investigating protein conformational dynamics. The former provide time-series data, such as donor-acceptor distances, whereas the latter give atomistic information, although this information is often bias...

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Detalhes bibliográficos
Publicado no:eLife
Main Authors: Matsunaga, Yasuhiro, Sugita, Yuji
Formato: Artigo
Idioma:Inglês
Publicado em: eLife Sciences Publications, Ltd 2018
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC5933924/
https://ncbi.nlm.nih.gov/pubmed/29723137
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.7554/eLife.32668
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