Fig. 4.

a Docking of the ligand geraniin on the catalytic site of pig pancreatic alpha-amylase showing that all the programs evaluated found the same pose for this ligand with few differences. b The pose found by Autodock is in green, the pose found by Molegro is in blue and pose found by Gold is in gold. c Chemical structure of geraniin (PubChem CID: 3001497)