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Molecular dynamics re-refinement of two different small RNA loop structures using the original NMR data suggest a common structure
Restrained molecular dynamics simulations are a robust, though perhaps underused, tool for the end-stage refinement of biomolecular structures. We demonstrate their utility—using modern simulation protocols, optimized force fields, and inclusion of explicit solvent and mobile counterions—by re-inves...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Springer Netherlands
2012
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3405240/ https://www.ncbi.nlm.nih.gov/pubmed/22714631 http://dx.doi.org/10.1007/s10858-012-9642-5 |