Arne Schneuing, Charles Harris, Yuanqi Du, Kieran Didi, Arian Rokkum Jamasb, Ilia Igashov, Weitao Du, Carla P. Gomes, Tom L. Blundell, Pietro Lio, Max Welling, Michael M. Bronstein, Bruno E. Correia. Structure-based drug design with equivariant diffusion models. Nat. Comput. Sci., 4(12):899-909, December 2024. [doi]
Abstract is missing.