Improving efficiency in rationale discovery for Out-of-Distribution molecular representations. - Jiahui Zhang; Jiahe Li 011; Wenjie Du; Shuai Zhang; Di Wu; Yang Wang (BIBM, 2023)

MolCLW: Molecular Contrastive Learning With Learnable Weighted Substructures. - Jiahe Li 011; Wenjie Du; Yang Wang (BIBM, 2024)