2014
DOI: 10.1002/minf.201300168
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Identification of Aurora‐A Inhibitors by Ligand and Structure‐Based Virtual Screening

Abstract: Aurora kinase A has been identified as one of the most attractive targets for cancer therapy because of its critical role in the regulation of the cell cycle. In order to identify active compounds with structural diversity we performed virtual screening. 3D-QSAR pharmacophore models were developed and the best model was used as a query for screening the databases. Ligand and structure-based virtual screening protocol was conducted sequentially by applying the common feature pharmacophore and molecular docking … Show more

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