Generation of OPLS-like charges from molecular electrostatic potential using restraints. - Richard H. Henchman; Jonathan W. Essex (J. Comput. Chem., 1999)

Free energies of hydration using restrained electrostatic potential derived charges via free energy perturbations and linear response. - Richard H. Henchman; Jonathan W. Essex (J. Comput. Chem., 1999)

Extracting hydration sites around proteins from explicit water simulations. - Richard H. Henchman; James Andrew McCammon (J. Comput. Chem., 2002)

Inhibitors of PIM-1 Kinase: A Computational Analysis of the Binding Free Energies of a Range of Imidazo [1, 2-b] Pyridazines. - Slimane Doudou; Raman Sharma; Richard H. Henchman; David W. Sheppard; Neil A. Burton (J. Chem. Inf. Model., 2010)

Overcoming the limitations of cutoffs for defining atomic coordination in multicomponent systems. - Jonathan Higham; Richard H. Henchman (J. Comput. Chem., 2018)

Entropy of Simulated Liquids Using Multiscale Cell Correlation. - Hafiz Saqib Ali; Jonathan Higham; Richard H. Henchman (Entropy, 2019)

Entropy of Proteins Using Multiscale Cell Correlation. - Arghya Chakravorty; Jonathan Higham; Richard H. Henchman (J. Chem. Inf. Model., 2020)

Extending the Martini Coarse-Grained Force Field to N-Glycans. - Aishwary T. Shivgan; Jan K. Marzinek; Roland G. Huber; Alexander Krah; Richard H. Henchman; Paul Matsudaira; Chandra S. Verma 001; Peter J. Bond (J. Chem. Inf. Model., 2020)

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)

Energy-entropy prediction of octanol-water logP of SAMPL7 N-acyl sulfonamide bioisosters. - Fabio Falcioni; Jas Kalayan; Richard H. Henchman (J. Comput. Aided Mol. Des., 2021)