David W Wright

Rapid, Accurate, Precise, and Reliable Relative Free Energy Prediction Using Ensemble Based Thermodynamic Integration.

Peter V Coveney, Shunzhou Wan, Agastya P Bhati, 2017, Journal of chemical theory and computation.

An Ensemble-Based Protocol for the Computational Prediction of Helix–Helix Interactions in G Protein-Coupled Receptors using Coarse-Grained Molecular Dynamics

Peter V Coveney, David W Wright, Andrea Townsend-Nicholson, 2017, Journal of chemical theory and computation.