BiochemistrybioRxivPreprint
SyntheMol-RL: a flexible reinforcement learning framework for designing novel and synthesizable antibiotics
Kyle Swanson, Gary K. Liu, Denise B. Catacutan…·Jonathan M. Stokes
SyntheMol-RL generates novel and synthesizable antibiotics by optimizing for antibacterial activity and solubility, outperforming prior models and showing in vitro and in vivo efficacy.