Torsionnet: A reinforcement learning approach to sequential conformer search T Gogineni, Z Xu, E Punzalan, R Jiang, J Kammeraad, A Tewari, ... Advances in Neural Information Processing Systems 33, 20142-20153, 2020 | 35 | 2020 |
Conformer‐RL: A deep reinforcement learning library for conformer generation R Jiang, T Gogineni, J Kammeraad, Y He, A Tewari, PM Zimmerman Journal of Computational Chemistry 43 (27), 1880-1886, 2022 | 1 | 2022 |