publications

2026

  1. Implicit Maximum Likelihood Estimation for Real-time Generative Model Predictive Control
    Grayson Lee, Minh Bui, Shuzi Zhou, and 3 more authors
    IEEE International Conference on Robotics and Automation (ICRA), 2026

2024

  1. TacoGFN: Target-conditioned GFlowNet for Structure-based Drug Design
    Tony Shen, Seonghwan Seo, Grayson Lee, and 5 more authors
    Transactions on Machine Learning Research (TMLR), 2024
  2. Preprint
    Geometric-informed GFlowNets for Structure-Based Drug Design
    Grayson Lee, Tony Shen, and Martin Ester
    arXiv preprint arXiv:2406.10867, 2024
    MoML 2024 (Spotlight)