Computing the relative binding affinity of ligands based on a pairwise binding comparison network.
Yu J, Li Z, Chen G, Kong X, Hu J, Wang D, Cao D, Li Y, Huo R, Wang G, Liu X, Jiang H, Li X, Luo X, Zheng M.
Yu J, et al. Among authors: chen g.
Nat Comput Sci. 2023 Oct;3(10):860-872. doi: 10.1038/s43588-023-00529-9. Epub 2023 Oct 19.
Nat Comput Sci. 2023.
PMID: 38177766
Free PMC article.