Jinhang Wei

SMARTFlexDB links ligand-bound and ligand-free RNA structures to study conformational flexibility and small-molecule recognition, providing a resource for RNA-targeted drug discovery.

GatorAffinity improves protein-ligand binding affinity prediction by combining synthetic structural data with experimental data, achieving better accuracy and generalizability.

This paper introduces EADTN, an ensemble model for drug-target interactions that improves predictive performance and identifies false-negative samples through adaptive feature weighting and clustering fine-tuning.