Jingxiao Bao

DeepBSP—a Machine Learning Method for Accurate Prediction of Protein–Ligand Docking Structures

Jingxiao Bao, Xiao He, John Z. H. Zhang · Journal of Chemical Information and Modeling · 2021 · 86 citations

Engineering, Machine Learning, Biomolecular Structure Prediction +22

Novel 3D Structure Based Model for Activity Prediction and Design of Antimicrobial Peptides

Shicai Liu, Jingxiao Bao, Xingzhen Lao et al. · Scientific Reports · 2018 · 63 citations · Full text

Discovery of Baicalin as NDM-1 inhibitor: Virtual screening, biological evaluation and molecular simulation

Shi Cheng, Jingxiao Bao, Ying Sun et al. · Bioorganic Chemistry · 2019 · 31 citations

Medicinal Chemistry, Virtual Screening, Engineering +11

Study of SHMT2 Inhibitors and Their Binding Mechanism by Computational Alanine Scanning

Liping He, Jingxiao Bao, Yunpeng Yang et al. · Journal of Chemical Information and Modeling · 2019 · 30 citations

FFLOM: A Flow-Based Autoregressive Model for Fragment-to-Lead Optimization

Jieyu Jin, Dong Wang, Guqin Shi et al. · Journal of Medicinal Chemistry · 2023 · 27 citations

Mathematical Programming, Large-scale Global Optimization, Engineering +20