David S. Cerutti

On the fly estimation of host–guest binding free energies using the movable type method: participation in the SAMPL5 blind challenge

Zheng Zheng, Kenneth M. Merz, Nupur Bansal, 2016, Journal of Computer-Aided Molecular Design.

Alchemical prediction of hydration free energies for SAMPL

David L. Mobley, Julia E. Rice, William C. Swope, 2012, Journal of Computer-Aided Molecular Design.

Amber 2015, University of California, San Francisco

Holger Gohlke, Ray Luo, Adrian E. Roitberg, 2015 .