An implicit boundary integral method for computing electric potential of macromolecules in solvent

Abstract

A numerical method using implicit surface representations is proposed to solve the linearized Poisson-Boltzmann equations that arise in mathematical models for the electrostatics of molecules in solvent. The proposed method used an implicit boundary integral formulation to derived a linear system defined on Cartesian nodes in a narrowband surrounding the… (More)
DOI: 10.1016/j.jcp.2018.01.021

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