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BINANA: A Novel Algorithm for Ligand-Binding Characterization

Computational chemists and structural biologists are often interested in characterizing ligand-receptor complexes for hydrogen-bond, hydrophobic, salt-bridge, van der Waals, and other interactions in order to assess ligand binding. When done by hand, this characterization can become tedious, especia...

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Detalhes bibliográficos
Main Authors: Durrant, Jacob D., McCammon, J. Andrew
Formato: Artigo
Idioma:Inglês
Publicado em: 2011
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3099006/
https://ncbi.nlm.nih.gov/pubmed/21310640
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.jmgm.2011.01.004
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