Bian-Xia Bai

COPAL: An ensemble of protein-ligand co-folding models enriches preferred ligand predictions for the LuxR-family of quorum sensing receptors

The COPAL (combining ordered predictions of audited ligands) pipeline, which integrates multiple protein-ligand co-folding models to identify preferred AHLs for a specific LuxR, shows that unweighted rank aggregation of complementary co-folding models offers a general strategy for predicting receptor-ligand specificity...