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An analytical approach to computing biomolecular electrostatic potential. I. Derivation and analysis

Analytical approximations to fundamental equations of continuum electrostatics on simple shapes can lead to computationally inexpensive prescriptions for calculating electrostatic properties of realistic molecules. Here, we derive a closed-form analytical approximation to the Poisson equation for an...

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Detalhes bibliográficos
Main Authors: Fenley, Andrew T., Gordon, John C., Onufriev, Alexey
Formato: Artigo
Idioma:Inglês
Publicado em: American Institute of Physics 2008
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2671191/
https://ncbi.nlm.nih.gov/pubmed/19044802
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.2956497
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