Stacking in RNA: NMR of Four Tetramers Benchmark Molecular Dynamics

[Image: see text] Molecular dynamics (MD) simulations for RNA tetramers r(AAAA), r(CAAU), r(GACC), and r(UUUU) are benchmarked against (1)H–(1)H NOESY distances and (3)J scalar couplings to test effects of RNA torsion parametrizations. Four different starting structures were used for r(AAAA), r(CAAU...

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Publié dans:J Chem Theory Comput
Auteurs principaux: Condon, David E., Kennedy, Scott D., Mort, Brendan C., Kierzek, Ryszard, Yildirim, Ilyas, Turner, Douglas H.
Format: Artigo
Langue:Inglês
Publié: American Chemical Society 2015
Accès en ligne:https://ncbi.nlm.nih.gov/pmc/articles/PMC4463549/
https://ncbi.nlm.nih.gov/pubmed/26082675
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ct501025q
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