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AutoDockFR: Advances in Protein-Ligand Docking with Explicitly Specified Binding Site Flexibility
Automated docking of drug-like molecules into receptors is an essential tool in structure-based drug design. While modeling receptor flexibility is important for correctly predicting ligand binding, it still remains challenging. This work focuses on an approach in which receptor flexibility is model...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Public Library of Science
2015
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4667975/ https://www.ncbi.nlm.nih.gov/pubmed/26629955 http://dx.doi.org/10.1371/journal.pcbi.1004586 |