Open access
Aug 2026
Elucidating enzyme–substrate specificity through co-folding foundation model
Boltz2ESI is introduced, an end-to-end framework that predicts enzyme–substrate interactions by leveraging structural knowledge learned by a biomolecular foundation model and consistently outperforms state-of-the-art sequence-based and rigid-docking approaches.
Xi-Wei Cheng, Seonghwan Seo, C. Huh et al.
· bioRxiv · 0 citations