Exploring the Mechanism of Qigesan in Treating Esophageal Carcinoma Based on Network Pharmacology, Molecular Docking, and MolecularDynamics Simulation

These findings provide a comprehensive elucidation of the multi-component, multi-target therapeutic strategy employed by QGS in the treatment of EC, laying a solid theoretical foundation for subsequent pharmacological development and clinical validation.

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Publication Details

Journal
Current Computer - Aided Drug Design
Published
2026-01-12
DOI
https://doi.org/10.2174/0115734099414317251126094602
Primary Topic
Computational Drug Discovery Methods
Type
article
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article

Exploring the Mechanism of Qigesan in Treating Esophageal Carcinoma Based on Network Pharmacology, Molecular Docking, and MolecularDynamics Simulation

Shixin Ye, Jiayi Yin, W. S. Li, Xiongfeng Huang et al.
Current Computer - Aided Drug Design
Computational Drug Discovery Methods
article

Exploring the Mechanism of Qigesan in Treating Esophageal Carcinoma Based on Network Pharmacology, Molecular Docking, and MolecularDynamics Simulation

Shixin Ye, Jiayi Yin, W. S. Li, Xiongfeng Huang, yousheng hu, Shulei Zhang, Bugao Zhou, Meihua Tang, Haolan You
article en

Abstract

These findings provide a comprehensive elucidation of the multi-component, multi-target therapeutic strategy employed by QGS in the treatment of EC, laying a solid theoretical foundation for subsequent pharmacological development and clinical validation.

Current Computer - Aided Drug DesignVol. 22
Jiangxi University of Traditional Chinese Medicine (CN), Fujian Medical University (CN), Nanchang University (CN), Nanchang Center for Disease Control and Prevention (CN), Fuzhou University (CN)
Good health and well-being
Openalex Percentile: Top 78%
Computational Drug Discovery Methods
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