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Electrostatics in protein–protein docking

A novel geometric-electrostatic docking algorithm is presented, which tests and quantifies the electrostatic complementarity of the molecular surfaces together with the shape complementarity. We represent each molecule to be docked as a grid of complex numbers, storing information regarding the shap...

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Detalhes bibliográficos
Main Authors: Heifetz, Alexander, Katchalski-Katzir, Ephraim, Eisenstein, Miriam
Formato: Artigo
Idioma:Inglês
Publicado em: Cold Spring Harbor Laboratory Press 2002
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2373470/
https://ncbi.nlm.nih.gov/pubmed/11847280
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