Prediction of Binding Sites in Receptor-Ligand Complexes with the Gaussian Network Model
Türkan Haliloǧlu, Emek Seyrek, Burak Erman · Physical Review Letters · 2008
Residues at the binding sites of the ligand and receptor of several enzyme-inhibitor and antibody-antigen complexes are predicted from the slowest (for the ligand) and fastest (for the receptor) modes of motion by the Gaussian Network Model applied to unbound molecules.