Investigating the Fracture Treatment Mechanism of Dipsacus asper Based on Network Pharmacology, Molecular Docking, and Molecular Dynamics Simulation

This study investigated the active components of Dipsacus asper (DA)in promoting fracture healing and their molecular mechanisms.The DA chemical constituents were sourced from the TCMSP and HERB databases.Six key components were identified based on the top six Degree values, including Japonine, ursolic acid, and Sweroside aglycone, among which exhibited the binding energy with NTRK1 (-6.69 kcal/mol), MMP9 (-6.62 kcal/mol), and CA2 (-5.86 kcal/mol).KEGG enrichment analysis