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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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Bibliografske podrobnosti
Main Authors: Fenley, Andrew T., Gordon, John C., Onufriev, Alexey
Format: Artigo
Jezik:Inglês
Izdano: American Institute of Physics 2008
Teme:
Online dostop: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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