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Empirical Corrections to the Amber RNA Force Field with Target Metadynamics
[Image: see text] The computational study of conformational transitions in nucleic acids still faces many challenges. For example, in the case of single stranded RNA tetranucleotides, agreement between simulations and experiments is not satisfactory due to inaccuracies in the force fields commonly u...
Autores principales: | Gil-Ley, Alejandro, Bottaro, Sandro, Bussi, Giovanni |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American
Chemical Society
2016
|
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4910146/ https://www.ncbi.nlm.nih.gov/pubmed/27153317 http://dx.doi.org/10.1021/acs.jctc.6b00299 |
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