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Constructing RNA dynamical ensembles by combining MD and motionally decoupled NMR RDCs: new insights into RNA dynamics and adaptive ligand recognition

We describe a strategy for constructing atomic resolution dynamical ensembles of RNA molecules, spanning up to millisecond timescales, that combines molecular dynamics (MD) simulations with NMR residual dipolar couplings (RDC) measured in elongated RNA. The ensembles are generated via a Monte Carlo...

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Detalles Bibliográficos
Main Authors: Frank, Aaron T., Stelzer, Andrew C., Al-Hashimi, Hashim M., Andricioaei, Ioan
Formato: Artigo
Idioma:Inglês
Publicado: Oxford University Press 2009
Assuntos:
RNA
Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC2699496/
https://ncbi.nlm.nih.gov/pubmed/19369218
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1093/nar/gkp156
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