Kyungreem Han, Phillip S. Hudson, Michael R. Jones, Naohiro Nishikawa, Florentina Tofoleanu, Bernard R. Brooks. Prediction of CB[8] host-guest binding free energies in SAMPL6 using the double-decoupling method. Journal of Computer-Aided Molecular Design, 32(10):1059-1073, 2018. [doi]
Abstract is missing.