Structure prediction of protein-ligand complexes from sequence information with Umol
Patrick Bryant, Atharva Kelkar, Andrea Guljas, Cecilia Clementi, Frank Noé
This paper introduces Umol, an AI system that predicts protein-ligand complex structures from sequence and ligand SMILES, outperforming existing methods at high accuracy.
bioRxiv · Nov 3, 2023 · PreprintBioinformatics