TorsionNet: A Reinforcement Learning Approach to Sequential Conformer Search. - Tarun Gogineni; Ziping Xu; Exequiel Punzalan; Runxuan Jiang; Joshua Kammeraad; Ambuj Tewari; Paul M. Zimmerman (NeurIPS, 2020)

Conformer-RL: A deep reinforcement learning library for conformer generation. - Runxuan Jiang; Tarun Gogineni; Joshua Kammeraad; Yifei He; Ambuj Tewari; Paul M. Zimmerman (J. Comput. Chem., 2022)

Sample Efficient Myopic Exploration Through Multitask Reinforcement Learning with Diverse Tasks. - Ziping Xu; Zifan Xu; Runxuan Jiang; Peter Stone 001; Ambuj Tewari (ICLR, 2024)