title: Automated docking of glucoamylase substrates and inhibitors.
authors.affiliation: Department of Chemical Engineering, Iowa State University, Ames 50011, USA.
authors.forename: P M
authors.initials: PM
authors.lastname: Coutinho
authors.forename: M K
authors.initials: MK
authors.lastname: Dowd
authors.forename: P J
authors.initials: PJ
authors.lastname: Reilly
mesh_terms: D001230:Aspergillus / Q000201:enzymology; D001665:Binding Sites; D005087:Glucan 1,4-alpha-Glucosidase / Q000037:antagonists & inhibitors* / Q000737:chemistry*; D005960:Glucosides / Q000737:chemistry; D008024:Ligands; D008958:Models, Molecular; D014867:Water / Q000737:chemistry
chemical_list: D005960:Glucosides; D008024:Ligands; D014867:Water; D005087:Glucan 1,4-alpha-Glucosidase