Offline RL for generative design of protein binders
Denis Tarasov, Ulrich Armel Mbou Sob, Miguel Arbesú, Nima Hamidi Siboni, Sebastien Boyer, Marcin J. Skwark, Andries Smit, Oliver Bent, Arnu Pretorius
This study applies offline reinforcement learning to generate protein binders with improved docking and chemical properties by addressing the computational cost of protein-ligand docking.
bioRxiv · Nov 29, 2023 · PreprintBioinformatics