Semantic substructure guided multiple objective molecular generation with discrete diffusion probabilistic model. - Shugao Chen; Bosheng Song; Ruizhe Chen; Lin Liu; Guifei Zhou; Sisi Yuan (Neurocomputing, 2025)

Pretraining graph transformer for molecular representation with fusion of multimodal information. - Ruizhe Chen; Chunyan Li 002; Longyue Wang; Mingquan Liu; Shugao Chen; Jiahao Yang; Xiangxiang Zeng (Inf. Fusion, 2025)