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Polarizable Force Fields for Biomolecular Modeling

Abstract

Molecular-mechanics-based modeling has been widely used in the study of chemical and biological systems. The classical potential energy functions and their parameters are referred to as force fields....
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Dates and versions

hal-01114184 , version 1 (03-11-2015)

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Yue Shi, Pengyu Ren, Michael Schnieders, Jean-Philip Piquemal. Polarizable Force Fields for Biomolecular Modeling. Reviews in Computational Chemistry, 28 (51), Wiley, 2015, ⟨10.1002/9781118889886.ch2⟩. ⟨hal-01114184⟩
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