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Equilibrium conformational dynamics in an RNA tetraloop from massively parallel molecular dynamics

Conformational equilibrium within the ubiquitous GNRA tetraloop motif was simulated at the ensemble level, including 10 000 independent all-atom molecular dynamics trajectories totaling over 110 µs of simulation time. This robust sampling reveals a highly dynamic structure comprised of 15 conformati...

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Hlavní autoři: DePaul, Allison J., Thompson, Erik J., Patel, Sarav S., Haldeman, Kristin, Sorin, Eric J.
Médium: Artigo
Jazyk:Inglês
Vydáno: Oxford University Press 2010
Témata:
On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC2919701/
https://ncbi.nlm.nih.gov/pubmed/20223768
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1093/nar/gkq134
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