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An analytical approach to computing biomolecular electrostatic potential. II. Validation and applications

An ability to efficiently compute the electrostatic potential produced by molecular charge distributions under realistic solvation conditions is essential for a variety of applications. Here, the simple closed-form analytical approximation to the Poisson equation rigorously derived in Part I for ide...

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Autors principals: Gordon, John C., Fenley, Andrew T., Onufriev, Alexey
Format: Artigo
Idioma:Inglês
Publicat: American Institute of Physics 2008
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC2671192/
https://ncbi.nlm.nih.gov/pubmed/19044803
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.2956499
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