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A total of 53 result was found. Results that relate to Molecular docking

Investigation of the mechanisms of action of Shuanghuanglian in treating res-piratory syncytial virus infection based on network pharmacology, molecular docking and molecular dynamics simulations

Published on Frontiers in Pharmaceutical Sciences 2026,30(5):737-747.
2028 times 408 times

REN Shuanshan ZHANG Yuqin MOU Jing YIN Shuqing WANG Lingling

Shuanghuanglian Respiratory syncytial virus GEO data Network pharmacology Molecular docking Molecular dynamics simulation Protein-protein interaction
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Study on the effect and mechanism of Polygoni Orientalis Fructus on nonalcoholic fatty liver disease based on network pharmacology and experimental validation

Published on Frontiers in Pharmaceutical Sciences 2026,30(6):901-909.
1769 times 419 times

GAO Shuchang HAN Danrui MA Donglai WANG Xiaona DUAN Xuhong

Polygoni Orientalis Fructus NAFLD Network pharmacology Molecular docking Signaling pathway Mechanism of action Zebrafish model Lipid metabolism
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The mechanism of Huanglian Jiedu Decoction in the treatment of acute mastitis with blazing heat-toxin pattern based on network pharmacology and molecular docking

Published on Journal of Mathematical Medicine 2026,39(6):426-435.
1541 times 436 times

WANG Lingling ZHANG Shengliang FENG Xuan ZHAO Changwei LI Yantao

Huanglian Jiedu Decoction Acute mastitis Blazing heat-toxin pattern Network pharmacology Molecular docking Mechanism
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Study on the mechanism of action of the Shengjiang powder plus Huanglian decoction in diabetes based on network pharmacology and animal experiments

Published on Frontiers in Pharmaceutical Sciences 2026,30(6):910-919.
1810 times 386 times

LAN Xinjian DING Tao LIU Bo WANG Xin CHEN Biao QIN Jia FU Shuang

Shengjiang powder plus Huanglian decoction Network pharmacology Molecular docking Diabetes Tumor necrosis factor Epidermal growth factor receptor
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Anti‑fatigue effect of Hibiscus manihot L. and its potential mechanism based on network pharmacology

Published on Frontiers in Pharmaceutical Sciences 2026,30(6):920-933.
1713 times 401 times

DU Junxia ZHU Xiumin LIU Hualiang

Hibiscus manihot L. Anti-fatigue Weight loaded swimming test Network pharmacology Molecular docking Inflammatory response AKT1 HSP90AA1
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The potential mechanism of Polygonatum sibiricum polysaccharide in the treatment of alcohol-related liver disease based on network pharmacology and molecular docking technology

Published on Journal of Mathematical Medicine 2026,39(7):471-483.
649 times 205 times

FAN Mingdong WAN Hongbing YANG Shaotong CHI Xuehan NING Xin

Polygonatum sibiricum polysaccharide Alcohol-related liver disease Structural units Network pharmacology Molecular docking
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Exploration of the toxicity mechanism of acetyl tributyl citrate exposure on Alzheimer's disease based on network toxicology and molecular docking

Published on Journal of Mathematical Medicine 2026,39(7):484-496.
549 times 177 times

ZHOU Tanyue CHEN Xuwu LI Daoyuan HOU Guanzhi WEI Xiaoqian ZHOU Qiyi DAI Dongmei REN Cailing

Acetyl tributyl citrate Alzheimer's disease Network toxicology Molecular docking Neurotoxicity
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Mechanism study of glycyrrhizin in the treatment of oral squamous cell carcinoma based on network pharmacology and in vitro cell experiments

Published on Frontiers in Pharmaceutical Sciences 2026,30(7):1081-1091.
489 times 146 times

TIAN Zhongjia LEI Yintao LI Junfu WANG Qian

Glycyrrhizin Oral squamous cell carcinoma Network pharmacology Molecular docking Notch signaling pathway
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