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