Functionally Regionalized Knowledge Transfer for Low-resource Drug Discovery. - Huaxiu Yao; Ying Wei 001; Long-Kai Huang; Ding Xue; Junzhou Huang; Zhenhui Li (NeurIPS, 2021)

DrugOOD: Out-of-Distribution (OOD) Dataset Curator and Benchmark for AI-aided Drug Discovery - A Focus on Affinity Prediction Problems with Noise Annotations. - Yuanfeng Ji; Lu Zhang 060; Jiaxiang Wu 001; Bingzhe Wu; Long-Kai Huang; Tingyang Xu; Yu Rong 001; Lanqing Li; Jie Ren; Ding Xue; Houtim Lai; Shaoyong Xu; et al. (CoRR, 2022)

DrugOOD: Out-of-Distribution Dataset Curator and Benchmark for AI-Aided Drug Discovery - a Focus on Affinity Prediction Problems with Noise Annotations. - Yuanfeng Ji; Lu Zhang 060; Jiaxiang Wu 001; Bingzhe Wu; Lanqing Li; Long-Kai Huang; Tingyang Xu; Yu Rong 001; Jie Ren; Ding Xue; Houtim Lai; Wei Liu 005; et al. (AAAI, 2023)