Omid Mokhtari

SIMORGH predicts ligand binding sites from apo proteins by integrating conformational ensembles, outperforming existing methods in ligand-free settings and identifying cryptic pockets.

DynamicGT improves protein binding interface prediction by incorporating dynamic features and conformational changes, outperforming static models on flexible and disordered regions.

DynaRepo provides a repository of macromolecular conformational dynamics with simulations and analyses for over 450 complexes and 270 proteins.