Fig. 4From: Predicting chemical structure using reinforcement learning with a stack-augmented conditional variational autoencoderNovelty of the top 100 molecules: Structures of the top 100 scoring molecules are not similar to that of sorafenib (a) and FDA-approved drugs (b), within a similarity limit of 95%. The top 100 scoring molecules do not overlap DrugBank and FDA-approved drugs within a similarity limit of 90% (see c). All analyses were performed using DataWarrior 5.5.0Back to article page