Integrative computational approaches, molecular docking, and dynamic simulations reveal the antimycobacterial activity of fisetin as a potential inhibitor of Mycobacterium tuberculosis
综合计算方法、分子对接和动态模拟揭示了非瑟酮作为结核分枝杆菌潜在抑制剂的抗分枝杆菌活性
期刊:Journal of Computer-Aided Molecular Design
影响因子:3.1
doi:10.1007/s10822-026-00786-6
Khan, Sajjad Ahmed; Rather, Muzafar Ahmad; Jia, Ziyi; Khan, Muhammad Umer; Qadir, Syed Mehmood; Ahmed, Niaz; Ejaz, Hasan; Alruwaili, Muharib; Baughn, Anthony D; Shier, W Thomas; Ahmad, Muhammad Sheeraz