Reduction of False Positives in Structure-Based Virtual Screening When Receptor Plasticity Is Considered

Structure-based virtual screening for selecting potential drug candidates is usually challenged by how numerous false positives in a molecule library are excluded when receptor plasticity is considered. In this study, based on the binding energy landscape theory, a hypothesis that a true inhibitor c...

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Bibliographic Details
Main Authors: Yaw Awuni, Yuguang Mu
Format: Article
Language:English
Published: MDPI AG 2015-03-01
Series:Molecules
Subjects:
Online Access:http://www.mdpi.com/1420-3049/20/3/5152