Designing novel linagliptin analogs through combined generative artificial intelligence, molecular docking, molecular dynamics simulation, and binding energy estimation for targeting fibroblast activation protein
Mingsong Shi, Mingsong Shi, Zhi Yang, Yuhan Yang et al. • Frontiers in Chemistry
(2026)
Fibroblast activation protein (FAP) is a highly specific biomarker overexpressed in cancer-associated fibroblasts, making it a promising diagnostic target. Developing novel high-affinity molecular probes for FAP-targeted diagnostics remains...
DOAJ
Open Access (DOAJ)
DOI:
10.3389/fchem.2026.1848970