Works by Zhang, Ya-Kun

Results: 16

Design and Evaluation of Novel Selective BET BD2 Inhibitors by Combining QSAR, Molecular Docking and Molecular Dynamics Simulation Techniques.

Published in:

Chemistry & Biodiversity, 2025, v. 22, n. 6, p. 1, doi. 10.1002/cbdv.202403038

By:

Tong, Jian‐Bo;
Sun, Yue;
Chang, Ze‐Lei;
Zhang, Ya‐Kun;
Xing, Xiao‐Yu;
Yan, Jing;
Li, Jia‐Le

Publication type:

Article

Research on ischemic stroke risk assessment based on CTA radiomics and machine learning.

Published in:

BMC Medical Imaging, 2025, v. 25, n. 1, p. 1, doi. 10.1186/s12880-025-01697-y

By:

Li, Zhi-Li;
Yang, Hong-Yu;
Lv, Xiao-Xiao;
Zhang, Ya-Kun;
Zhu, Xin-Yu;
Zhang, Yu-Rou;
Guo, Li

Publication type:

Article

Design and Development of New Generation ALK Inhibitors Driven by Structure–Activity Relationship Studies of 2,4‐Diarylaminopyrimidine Derivatives.

Published in:

ChemistrySelect, 2025, v. 10, n. 21, p. 1, doi. 10.1002/slct.202405589

By:

Zhang, Ya‐Kun;
Tong, Jian‐Bo;
Luo, Mu‐Xuan;
Sun, Yue;
Qin, Zhi‐Peng

Publication type:

Article

Design and molecular mechanism investigation of ALK inhibitors based on virtual screening and structural descriptor modeling.

Published in:

Journal of Receptors & Signal Transduction, 2025, v. 45, n. 3, p. 189, doi. 10.1080/10799893.2025.2503386

By:

Zhang, Ya-Kun;
Tong, Jian-Bo;
Sun, Yue;
Li, Jia-Le;
Hou, Qi

Publication type:

Article

Design and evaluation of piperidine carboxamide derivatives as potent ALK inhibitors through 3D-QSAR modeling, artificial neural network and computational analysis.

Published in:

Arabian Journal of Chemistry, 2024, v. 17, n. 9, p. N.PAG, doi. 10.1016/j.arabjc.2024.105863

By:

Zhang, Ya-Kun;
Tong, Jian-Bo;
Luo, Mu-Xuan;
Xing, Xiao-Yu;
Yang, Yu-Lu;
Qing, Zhi-Peng;
Chang, Ze-Lei;
Zeng, Yan-Rong

Publication type:

Article

Discovery of RET Inhibitors Targeting the V804M Mutation for Cancer Therapy Based on Molecular Modeling, Molecular Docking, and Molecular Dynamics Simulations.

Published in:

ChemistrySelect, 2025, v. 10, n. 15, p. 1, doi. 10.1002/slct.202404227

By:

Guo, Li‐Yuan;
Xing, Xiao‐Yu;
Tong, Jian‐Bo;
Zhang, Ya‐Kun;
Ren, Lei;
An, Chong‐Xin

Publication type:

Article

QSAR Modeling of Pyridone Derivatives as α‐amylase Inhibitors Using Chemical Descriptors and Machine Learning.

Published in:

ChemistrySelect, 2025, v. 10, n. 4, p. 1, doi. 10.1002/slct.202404214

By:

Zhang, Ya‐Kun;
Tong, Jian‐Bo;
Chang, Ze‐Lei;
Yan, Jing;
Xing, Xiao‐Yu;
Yang, Yu‐Lu;
Xue, Zhan

Publication type:

Article

Computational Studies of Novel Aniline Pyrimidine WDR5‐MLL1 Inhibitors: QSAR, Molecular Docking, and Molecular Dynamics Simulation.

Published in:

ChemistrySelect, 2024, v. 9, n. 36, p. 1, doi. 10.1002/slct.202402567

By:

Guo, Li Yuan;
Wang, Chun Ying;
Tong, Jian Bo;
Li, Peng;
Gao, Peng;
Liu, Yuan;
Zhang, Ya Kun;
Chang, Ze Lei;
Xing, Xiao Yu

Publication type:

Article

Discovery of New Heteroaryldihydropyrimidine Compounds as HBV Capsid Protein Inhibitors Based on QSAR, Molecular Docking and Molecular Dynamics Simulations.

Published in:

ChemistrySelect, 2024, v. 9, n. 29, p. 1, doi. 10.1002/slct.202401016

By:

Tong, Jian‐Bo;
Xing, Xiao‐Yu;
Zhang, Ya‐Kun;
Gao, Peng;
Liu, Yuan;
Zhang, Xing;
Chang, Ze‐Lei;
Yan, Jing;
Yang, Yu‐Lu;
Wang, Chun‐Ying;
Ding, Jing‐Yan

Publication type:

Article

QSAR Modeling, Molecular Docking and ADMET Study of Aryl Fluorosulfate Derivatives as Potential Anti-TB Agents.

Published in:

Polycyclic Aromatic Compounds, 2025, v. 45, n. 3, p. 423, doi. 10.1080/10406638.2024.2408461

By:

Zhang, Ya-Kun;
Tong, Jian-Bo;
Guo, Jia-Le;
Qing, Zhi-Peng

Publication type:

Article

Siccirubricoccus phaeus sp. nov., isolated from oil reservoir water and emended description of the genus Siccirubricoccus.

Published in:

Antonie van Leeuwenhoek, 2021, v. 114, n. 4, p. 355, doi. 10.1007/s10482-021-01516-8

By:

Li, Fang-Ling;
Zhang, Ya-Xi;
Zhang, Ya-Kun;
Chen, Wen-Feng;
Li, Wen-Jun;
Wang, Lei

Publication type:

Article

Chemical Constituents of Clerodendrum japonicum.

Published in:

Chemistry of Natural Compounds, 2023, v. 59, n. 4, p. 771, doi. 10.1007/s10600-023-04107-3

By:

Zhang, Ya-Kun;
Wang, Ting-Ting;
Huo, Xiao-Min;
Xue, Zhan;
Zhang, Hong-Yan;
Zeng, Yan-Rong;
Tan, Cheng-Jian

Publication type:

Article

Emulsifying Properties of Tremella Fuciformis: A Novel Promising Food Emulsifier.

Published in:

International Journal of Food Engineering, 2019, v. 15, n. 3/4, p. N.PAG, doi. 10.1515/ijfe-2018-0217

By:

Zhang, Jian;
Zhang, Ya-Kun;
Liu, Yong;
Wang, Jun-Hui

Publication type:

Article

Meta-Analysis of Shrinkage Mode After Neoadjuvant Chemotherapy for Breast Cancers: Association With Hormonal Receptor.

Published in:

Frontiers in Oncology, 2022, v. 12, p. 1, doi. 10.3389/fonc.2021.617167

By:

Zheng, Chun-Hui;
Xu, Kai;
Shan, Wen-Ping;
Zhang, Ya-Kun;
Su, Zhi-De;
Gao, Xiang-Jin;
Wang, Yu-Jue;
Qi, Jian-Yu;
Ding, Xiao-Yan;
Wang, Chun-Ping;
Wang, Yong-sheng

Publication type:

Article

Study on the anti-HBV activity of matrine alkaloids from Oxytropis ochrocephala by MTT, 3d-QSAR, molecular docking and molecular dynamics simulation.

Published in:

Journal of Asian Natural Products Research, 2025, v. 27, n. 3, p. 442, doi. 10.1080/10286020.2024.2402369

By:

Zhang, Ya-Kun;
Tong, Jian-Bo;
Tan, Jing;
Yang, Min;
Xing, Xiao-Yu;
Zeng, Yan-Rong;
Xue, Zhan;
Tan, Cheng-Jian

Publication type:

Article

Computational Simulation Study of Potential Inhibition of c‐Met Kinase Receptor by Phenoxy pyridine Derivatives: Based on QSAR, Molecular Docking, Molecular Dynamics.

Published in:

Chemistry & Biodiversity, 2024, v. 21, n. 10, p. 1, doi. 10.1002/cbdv.202400782

By:

Guo, Li‐yuan;
Yang, Yu‐lu;
Tong, Jian‐bo;
Chang, Ze‐lei;
Gao, Peng;
Liu, Yuan;
Zhang, Ya‐kun;
Xing, Xiao‐yu

Publication type:

Article