WaterAlignment: Identification of displaced water molecules in molecular docking using Jonker and Volgenant shortest path augmentation for linear assignment. - Dab Brill; Jason B. Giles; Ian S. Haworth; Aiichiro Nakano (Comput. Phys. Commun., 2019)

Prediction of Water Distributions and Displacement at Protein-Ligand Interfaces. - Noam Morningstar-Kywi; Kaichen Wang; Thomas R. Asbell; Zhaohui Wang; Jason B. Giles; Jiawei Lai; Dab Brill; Brian T. Sutch; Ian S. Haworth (J. Chem. Inf. Model., 2022)