Figure 2:

Docked binding poses of generated molecules without (left) and with (right) BioAssay context. With BioAssay context, ChatGPT 4o generates a molecule with three hydrogen bonds to the GRK4 pocket residue MET-267, improving the docking score.

Docked binding poses of generated molecules without (left) and with (right) BioAssay context. With BioAssay context, ChatGPT 4o generates a molecule with three hydrogen bonds to the GRK4 pocket residue MET-267, improving the docking score.