Nucleophilicity Prediction Using Graph Neural Networks. - Wan Nie; Deguang Liu; Shuaicheng Li 001; Haizhu Yu; Yao Fu 001 (J. Chem. Inf. Model., 2022)

Data-Based Prediction of Redox Potentials via Introducing Chemical Features into the Transformer Architecture. - Zhan Si; Deguang Liu; Wan Nie; Jingjing Hu; Chen Wang; Tingting Jiang; Haizhu Yu; Yao Fu 001 (J. Chem. Inf. Model., 2024)