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Pocket to concavity: a tool for the refinement of protein–ligand binding site shape from alpha spheres
SUMMARY: Understanding the binding site of the target protein is essential for rational drug design. Pocket detection software predicts the ligand binding site of the target protein; however, the predicted protein pockets are often excessively estimated in comparison with the actual volume of the bo...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Oxford University Press
2023
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10148677/ https://www.ncbi.nlm.nih.gov/pubmed/37086438 http://dx.doi.org/10.1093/bioinformatics/btad212 |