Generic protein-ligand interaction scoring by integrating physical prior knowledge and data augmentation modelling. - Duanhua Cao; Geng Chen; Jiaxin Jiang; Jie Yu; Runze Zhang; Mingan Chen; Wei Zhang; Lifan Chen; Feisheng Zhong; Yingying Zhang; Chenghao Lu; Xutong Li; et al. (Nat. Mac. Intell., 2024)

Reducing overconfident errors in molecular property classification using Posterior Network. - Zhehuan Fan; Jie Yu; Xiang Zhang; Yijie Chen; Shihui Sun; Yuanyuan Zhang; Mingan Chen; Fu Xiao; Wenyong Wu; Xutong Li; Mingyue Zheng; Xiaomin Luo; et al. (Patterns, 2024)