Open access
Jul 2026
A Combined Molecular Docking, Dynamics Simulation, and In Vitro Evaluation of Hydroxythioxanthones as Antidiabetic and Antioxidant Candidates
A comprehensive investigation of hydroxythioxanthone derivatives through an integrated methodology that includes molecular docking, molecular dynamics simulations, and in vitro evaluations of antidiabetic and antioxidant activities confirmed the stability of the ligand–protein complexes.
F. Hermawan, A. D. Puspitasari, R. Wulandari et al.
· Molekul · 0 citations