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Polarizable force fields for biomolecular simulations: Recent advances and applications

Realistic modeling of biomolecular systems requires an accurate treatment of electrostatics, including electronic polarization. Due to recent advances in physical models, simulation algorithms and computing hardware, biomolecular simulations with advanced force fields at biologically relevant time s...

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Detalhes bibliográficos
Publicado no:Annu Rev Biophys
Main Authors: Jing, Zhifeng, Liu, Chengwen, Cheng, Sara Y., Qi, Rui, Walker, Brandon D., Piquemal, Jean-Philip, Ren, Pengyu
Formato: Artigo
Idioma:Inglês
Publicado em: 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6520134/
https://ncbi.nlm.nih.gov/pubmed/30916997
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1146/annurev-biophys-070317-033349
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