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Prediction of Drug–Target Binding Kinetics by Comparative Binding Energy Analysis
[Image: see text] A growing consensus is emerging that optimizing the drug–target affinity alone under equilibrium conditions does not necessarily translate into higher potency in vivo and that instead binding kinetic parameters should be optimized to ensure better efficacy. Therefore, in silico met...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical
Society
2018
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6231175/ https://www.ncbi.nlm.nih.gov/pubmed/30429958 http://dx.doi.org/10.1021/acsmedchemlett.8b00397 |