Global Human-guided Counterfactual Explanations for Molecular Properties via Reinforcement Learning.

Mon, 01 Jan 2024 00:00:00 +0100

Danqing Wang, Antonis Antoniades, Kha-Dinh Luong, Edwin Zhang, Mert Kosan, Jiachen Li, Ambuj K. Singh, William Yang Wang, Lei Li:
Global Human-guided Counterfactual Explanations for Molecular Properties via Reinforcement Learning. CoRR abs/2406.13869 (2024)