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Improving hybrid statistical and physical forcefields through local structure enumeration
Forcefields used in biomolecular simulations are comprised of energetic terms that are physical in nature, based on parameter fitting to quantum mechanical simulation or experimental data, or statistical, drawing off high‐resolution structural data to describe distributions of molecular features. Co...
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| Publicado no: | Protein Sci |
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| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
John Wiley and Sons Inc.
2016
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4972208/ https://ncbi.nlm.nih.gov/pubmed/27239808 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/pro.2956 |
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