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...

Descripción completa

Detalles Bibliográficos
Autores principales: Born, Jannis, Shoshan, Yoel, Huynh, Tien, Cornell, Wendy D., Martin, Eric J., Manica, Matteo
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
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

Internet

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

Ejemplares similares