Constructing Innovative Covalent and Noncovalent Compound Libraries: Insights from 3D Protein-Ligand Interactions. - Xiaohe Xu; Weijie Han; Xiangzhen Ning; Chengdong Zang; Chengcheng Xu 006; Chen Zeng; Chengtao Pu; Yanmin Zhang; Yadong Chen 001; Haichun Liu (J. Chem. Inf. Model., 2024)

CGPDTA: An Explainable Transfer Learning-Based Predictor With Molecule Substructure Graph for Drug-Target Binding Affinity. - Qing Fan; Yingxu Liu; Simeng Zhang; Xiangzhen Ning; Chengcheng Xu 006; Weijie Han; Yanmin Zhang; Yadong Chen 001; Jun Shen; Haichun Liu (J. Comput. Chem., 2025)