d Abstract] Guizhen Yang Artificial Intelligence Center SRI International Menlo Park, CA 94025, USA Michael Kifer Dept. of Computer Science Stony Brook University Stony Brook, NY 1...
: The prediction of the binding free energy between a ligand and a protein is an important component in the virtual screening and lead optimization of ligands for drug discovery. T...
Background: With the advent of increasing sequence and structural data, a number of methods have been proposed to locate putative protein binding sites from protein surfaces. Ther...