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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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Bibliografiske detaljer
Udgivet i:Annu Rev Biophys
Main Authors: Jing, Zhifeng, Liu, Chengwen, Cheng, Sara Y., Qi, Rui, Walker, Brandon D., Piquemal, Jean-Philip, Ren, Pengyu
Format: Artigo
Sprog:Inglês
Udgivet: 2019
Fag:
Online adgang: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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