Scientific discovery in the age of artificial intelligenceHanchen Wang, Marinka Žitnik, Tianfan Fu et al.|Nature|2023Cited by 1.6k
Structure-based drug design with equivariant diffusion modelsArne Schneuing, Bruno E. Correia, Charles B. Harris et al.|Nature Computational Science|2024Cited by 162
Machine learning-aided generative molecular designYuanqi Du, Tom L. Blundell, Arian R. Jamasb et al.|Nature Machine Intelligence|2024Cited by 142
Deep learning to segment pelvic bones: large-scale CT datasets and baseline modelsPengbo Liu, S. Kevin Zhou, Feng Gu et al.|International Journal of Computer Assisted Radiology and Surgery|2021Cited by 136
Structure-based Drug Design with Equivariant Diffusion ModelsArne Schneuing, Bruno E. Correia, Charles B. Harris et al.|arXiv (Cornell University)|2022Cited by 100