Joshua Williams

Prediction of Absolute Solvation Free Energies using Molecular Dynamics Free Energy Perturbation and the OPLS Force Field.

W. Sherman, Devleena Shivakumar, J. Shelley, 2010, Journal of chemical theory and computation.

Leveraging Data Fusion Strategies in Multireceptor Lead Optimization MM/GBSA End-Point Methods.

Robert Abel, Richard A. Friesner, Jennifer L. Knight, 2014, Journal of chemical theory and computation.