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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...
Autores principales: | Awuni, Yaw, Mu, Yuguang |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2015
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6272817/ https://www.ncbi.nlm.nih.gov/pubmed/25808156 http://dx.doi.org/10.3390/molecules20035152 |
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