ASSESSMENT OF ALPHAFOLD PROTEIN MODELS FOR SMALL-MOLECULE LIGAND DOCKING
Hlib Maidanik, Maria Lazou, Rohin Bajaj, Raheel Sarwar, Sándor Vajda, Diane Joseph‐McCarthy
This study evaluates AlphaFold protein models for ligand docking, showing they outperform unbound structures and match ligand-bound structures in fragment docking.
bioRxiv · Jan 4, 2026 · PreprintBioinformatics