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February 15, 2006 (Vol. 26, No. 4)

In Silico Tools Streamline Drug Design

Visualizing the Interactions Between a Potential Drug and Its Proposed Target

  • LigandScout, released this month by Inte:Ligand (www.inteligand. com), features a 3-D pharmacophore modeling approach that, according to Inte:Ligand, offers significant time savings when compared to ligand docking. A pharmacophore search for millions of compounds can be performed within hours, notes Gerhard Wolber, Ph.D., CTO, while it takes several weeks ...

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