Jingyu Zhu

Publication Activity (10 Years)

Years Active: 2019-2024
Publications (10 Years): 9

Top Topics

Molecular Docking

Machine Learning

Tyrosine Kinase

Top Venues

Chemical biology & drug design

Molecular diversity

Journal of molecular modeling

Chemistry & biodiversity

This page only lists publications with an associated author ORCID identifier.

Publications

Genhong Qiu, Li Yu, Lei Jia, Yanfei Cai, Yun Chen, Jian Jin, Lei Xu, Jingyu Zhu
Identification of novel covalent JAK3 inhibitors through consensus scoring virtual screening: integration of common feature pharmacophore and covalent docking. Molecular diversity (2024)
Jingyu Zhu, Xintong Li, Huiqin Meng, Lei Jia, Lei Xu, Yanfei Cai, Yun Chen, Jian Jin, Li Yu, Mingzhu Gao
Molecular modeling strategy for detailing the primary mechanism of action of copanlisib to PI3K: combined ligand-based and target-based approach. Journal of biomolecular structure & dynamics (2023)
Jingyu Zhu, Lei Jia, Yingmin Jiang, Qianqian Yu, Lei Xu, Yanfei Cai, Yun Chen, Huazhong Li, Huang Gang, Wenqing Liang, Jian Jin
Integrated molecular modeling techniques to reveal selective mechanisms of inhibitors to PI3Kδ with marketed Idelalisib. Chemical biology & drug design 97 (6) (2021)
Jingyu Zhu, Yingmin Jiang, Lei Jia, Lei Xu, Yanfei Cai, Yun Chen, Nannan Zhu, Huazhong Li, Jian Jin
A multi-conformational virtual screening approach based on machine learning targeting PI3Kγ. Molecular diversity 25 (3) (2021)
Li Yu, Yingmin Jiang, Lei Xu, Jian Jin, Zejun Pei, Jingyu Zhu
Theoretical study of myriocin-binding mechanism targeting serine palmitoyltransferase. Chemical biology & drug design (2021)
Jingyu Zhu, Kan Li, Lei Xu, Jian Jin
Insight into the selective mechanism of phosphoinositide 3-kinase γ with benzothiazole and thiazolopiperidine γ-specific inhibitors by in silico approaches. Chemical biology & drug design 93 (5) (2019)
Jingyu Zhu, Ke Ke, Lei Xu, Jian Jin
Theoretical studies on the selectivity mechanisms of PI3Kδ inhibition with marketed idelalisib and its derivatives by 3D-QSAR, molecular docking, and molecular dynamics simulation. Journal of molecular modeling 25 (8) (2019)
Kan Li, Jingyu Zhu, Lei Xu, Jian Jin
Rational Design of Novel Phosphoinositide 3-Kinase Gamma (PI3Kγ) Selective Inhibitors: A Computational Investigation Integrating 3D-QSAR, Molecular Docking and Molecular Dynamics Simulation. Chemistry & biodiversity 16 (7) (2019)
Jingyu Zhu, Ke Ke, Lei Xu, Jian Jin
Discovery of a novel phosphoinositide 3-kinase gamma (PI3Kγ) inhibitor against hematologic malignancies and theoretical studies on its PI3Kγ-specific binding mechanisms. RSC advances 9 (35) (2019)