Optimal water networks in protein cavities with GAsol and 3D-RISM. - Lucia Fusani; Ian D. Wall; David Palmer 002; Álvaro Cortés Cabrera (Bioinform., 2018)

Active learning strategies with COMBINE analysis: new tricks for an old dog. - Lucia Fusani; Álvaro Cortés Cabrera (J. Comput. Aided Mol. Des., 2019)

Exploring Ligand Stability in Protein Crystal Structures Using Binding Pose Metadynamics. - Lucia Fusani; David S. Palmer; Don O. Somers; Ian D. Wall (J. Chem. Inf. Model., 2020)