The influence of dispersive interactions on the binding affinities of ligands with an arylpiperazine moiety to the dopamine D2 receptor

The influence of dispersive interactions on the binding affinities of ligands with an arylpiperazine moiety to the dopamine D2 receptor

Several isosteric 1,3-dihydro-5-[2-(4-aryl-1-piperazinyl)ethyl]-2H-benzimidazole-2-thiones were used to investigate the interactions of different ligands with the binding site of the D2 receptor. Due to limitations of the simulation methods, docking analysis failed to show precisely the interactions...

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Bibliographic Details
Main Authors: Zlatović Mario V., Šukalović Vladimir V., Roglić Goran M., Kostić-Rajačić Slađana V., Andrić Deana B.
Format: Article
Language:English
Published: Serbian Chemical Society 2009-01-01
Series:Journal of the Serbian Chemical Society
Subjects:
dispersive interactions
hybrid dft
ligand affinity
correlation
d2
Online Access:http://www.doiserbia.nb.rs/img/doi/0352-5139/2009/0352-51390910051Z.pdf

Internet

http://www.doiserbia.nb.rs/img/doi/0352-5139/2009/0352-51390910051Z.pdf

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