| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 521828 | Journal of Computational Physics | 2009 | 8 Pages |
Abstract
In this paper, we report a new development of image charge approximations of reaction fields for a charge inside a dielectric spherical cavity immersed in an ionic solvent with arbitrary ionic strength. This new development removes the requirement of low ionic strength of the solvent in a previous result [S. Deng, W. Cai, Extending the fast multipole method for charges inside a dielectric sphere in an ionic solvent: high-order image approximations for reaction fields, J. Comput. Phys. 227 (2007) 1246–1266], thus extending the applicability of the image charge approximations of reaction fields in the modeling of biomolecular solvation.
Related Topics
Physical Sciences and Engineering
Computer Science
Computer Science Applications
Authors
Zhenli Xu, Shaozhong Deng, Wei Cai,