Modeling Flexible Pharmacophores with Distance Geometry, Scoring, and Bound Stretching. - Michael Binns; Sam P. de Visser; Constantinos Theodoropoulos (J. Chem. Inf. Model., 2012)

Energy-entropy method using multiscale cell correlation to calculate binding free energies in the SAMPL8 host-guest challenge. - Hafiz Saqib Ali; Arghya Chakravorty; Jas Kalayan; Sam P. de Visser; Richard H. Henchman (J. Comput. Aided Mol. Des., 2021)