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Integration of experimental data and use of automated fitting methods in developing protein force fields
The development of accurate protein force fields has been the cornerstone of molecular simulations for the past 50 years. During this period, many lessons have been learned regarding the use of experimental target data and parameter fitting procedures. Here, we review recent advances in protein forc...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Nature Publishing Group UK
2022
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8979544/ https://www.ncbi.nlm.nih.gov/pubmed/35382231 http://dx.doi.org/10.1038/s42004-022-00653-z |