GroScore: Accurate Scoring of Protein-Protein Binding Poses Using Explicit-Solvent Free-Energy Calculations. - Jan Walther Perthold; Chris Oostenbrink (J. Chem. Inf. Model., 2019)

Toward Automated Free Energy Calculation with Accelerated Enveloping Distribution Sampling (A-EDS). - Jan Walther Perthold; Drazen Petrov; Chris Oostenbrink (J. Chem. Inf. Model., 2020)