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Probabilistic Prediction of Contacts in Protein-Ligand Complexes

We introduce a statistical method for evaluating atomic level 3D interaction patterns of protein-ligand contacts. Such patterns can be used for fast separation of likely ligand and ligand binding site combinations out of all those that are geometrically possible. The practical purpose of this probab...

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Detalhes bibliográficos
Main Authors: Hakulinen, Riku, Puranen, Santeri, Lehtonen, Jukka V., Johnson, Mark S., Corander, Jukka
Formato: Artigo
Idioma:Inglês
Publicado em: Public Library of Science 2012
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3498326/
https://ncbi.nlm.nih.gov/pubmed/23155467
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1371/journal.pone.0049216
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