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Self-Consistent Parameterization of DNA Residues for the Non-Polarizable AMBER Force Fields
Fixed-charge (non-polarizable) forcefields are accurate and computationally efficient tools for modeling the molecular dynamics of nucleic acid polymers, particularly DNA, well into the µs timescale. The continued utility of these forcefields depends in part on expanding the residue set in step with...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
MDPI
2022
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9143812/ https://www.ncbi.nlm.nih.gov/pubmed/35629334 http://dx.doi.org/10.3390/life12050666 |