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On the Choice of Active Site Sequences for Kinase-Ligand Affinity Prediction
[Image: see text] Recent work showed that active site rather than full-protein-sequence information improves predictive performance in kinase-ligand binding affinity prediction. To refine the notion of an “active site”, we here propose and compare multiple definitions. We report significant evidence...
| Autores principales: | , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2022
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9516689/ https://www.ncbi.nlm.nih.gov/pubmed/36098536 http://dx.doi.org/10.1021/acs.jcim.2c00840 |