Calculating binding free energies of host–guest systems using the AMOEBA polarizable force field

Citation:

D. R. Bell, Qi, R., Jing, Z., Xiang, J. Y., Mejias, C., Schnieders, M. J., Ponder, J. W., and Ren, P., “Calculating binding free energies of host–guest systems using the AMOEBA polarizable force field,” Physical Chemistry Chemical Physics, vol. 18, pp. 30261–30269, 2016.