Open access
Sep 2026
Structure-based multi-pocket virtual screening identifies FDA-approved candidate compounds targeting MPXV thymidylate kinase
The combined multi-pocket consensus screening and dynamic evaluation strategy provides a computational framework for antiviral drug repurposing and suggests that DB11791 may represent a promising TMK-targeting candidate.
Han-Wen Lu, Xiao-Dong Li, Zhan-Xiang Wang
· Frontiers in Cellular and In... · 0 citations