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Fast Analytical Methods for Macroscopic Electrostatic Models in Biomolecular Simulations

Zhenli Xu1, Wei Cai

  • 1Department of Mathematics and Institute of Natural Sciences, Shanghai Jiao Tong University, Shanghai 200240, People's Republic of China, and Department of Mathematics and Statistics, University of North Carolina, Charlotte, NC 28223 ( xuzl@sjtu.edu.cn ).

SIAM Review. Society for Industrial and Applied Mathematics
|June 8, 2013
PubMed

Keywords:
Poisson–Boltzmann equationelectrostatic free energyelectrostatic interactionsfast algorithmgeneralized Born theoryhybrid explicit/implicit solvation modelsimage charge approximationmacroscopic solvent modelsmultipole expansionreaction field

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