Molecular Simulation of Conformational Pre-Organization in Cyclic RGD Peptides. - Amanda E. Wakefield; William M. Wuest; Vincent A. Voelz (J. Chem. Inf. Model., 2015)

Benchmark Sets for Binding Hot Spot Identification in Fragment-Based Ligand Discovery. - Amanda E. Wakefield; Christine Yueh; Dmitri Beglov; Marcelo Santos Castilho; Dima Kozakov; György M. Keserü; Adrian Whitty; Sandor Vajda (J. Chem. Inf. Model., 2020)

Conservation of Allosteric Ligand Binding Sites in G-Protein Coupled Receptors. - Amanda E. Wakefield; Dávid Bajusz; Dima Kozakov; György M. Keserü; Sandor Vajda (J. Chem. Inf. Model., 2022)