BiophysicsbioRxivPreprint
Leveraging non-structural data to predict structures of protein-ligand complexes
J. M. Paggi, J. A. Belk, S. A. Hollingsworth…·R. O. Dror
This paper presents a statistical framework combining physics-based and ligand-based methods to predict protein-ligand complex structures, improving pose prediction accuracy for drug targets.
DOI 10.1101/2020.06.01.128181