Study of SHMT2 Inhibitors and Their Binding Mechanism by Computational Alanine Scanning. - Liping He; Jingxiao Bao; Yunpeng Yang; Suzhen Dong; Lujia Zhang; Yifei Qi; John Z. H. Zhang (J. Chem. Inf. Model., 2019)

Development of a New Scoring Function for Virtual Screening: APBScore. - Jingxiao Bao; Xiao He 004; John Z. H. Zhang (J. Chem. Inf. Model., 2020)

DeepBSP - a Machine Learning Method for Accurate Prediction of Protein-Ligand Docking Structures. - Jingxiao Bao; Xiao He 004; John Z. H. Zhang (J. Chem. Inf. Model., 2021)

ADMET evaluation in drug discovery: 21. Application and industrial validation of machine learning algorithms for Caco-2 permeability prediction. - Dong Wang; Jieyu Jin; Guqin Shi; Jingxiao Bao; Zheng Wang 027; Shimeng Li; Peichen Pan; Dan Li 013; Yu Kang 002; Tingjun Hou (J. Cheminformatics, 2025)