AIScore Chemically Diverse Empirical Scoring Function Employing Quantum Chemical Binding Energies of Hydrogen-Bonded Complexes

Stephan Raub, Andreas Steffen, Andreas Kämper, Christel M. Marian. AIScore Chemically Diverse Empirical Scoring Function Employing Quantum Chemical Binding Energies of Hydrogen-Bonded Complexes. Journal of Chemical Information and Computer Sciences, 48(7):1492-1510, 2008. [doi]

Abstract

Abstract is missing.