Ji, Yuanfeng, Lu Zhang, Jiaxiang Wu, Bingzhe Wu, Lanqing Li, Long-Kai Huang, Tingyang Xu, et al. “DrugOOD: Out-of-Distribution Dataset Curator and Benchmark for AI-Aided Drug Discovery – a Focus on Affinity Prediction Problems With Noise Annotations”. Proceedings of the AAAI Conference on Artificial Intelligence 37, no. 7 (June 26, 2023): 8023–8031. Accessed May 18, 2026. https://ojs.aaai.org/index.php/AAAI/article/view/25970.