Chemistry & biodiversityMolecular Docking SimulationMiceRAW 264.7 CellsNetwork PharmacologyAnimals
Exploring the Anti-Inflammatory Molecular Mechanism of Gentiana szechenyii Kanitz. Based on UPLC-MS/MS Combined With Network Pharmacology, Molecular Docking, and Molecular Dynamics Simulation.
Xingqing Liu, Mengshu Wang, Shengling Wu, Honglun Wang, Fangfang Tie, Na Hu, Wu Zhou, Qi Dong
Published: 202610.1002/cbdv.202502421
Abstract
This study explored the anti-inflammatory mechanisms of Gentiana szechenyii Kanitz. (GS), a Tibetan medicinal herb, by combining UPLC-MS/MS, network pharmacology, molecular docking, and molecular dynamics (MD) simulation. Using the lipopolysaccharide…
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