Cosolvent and Dynamic Effects in Binding Pocket Search by Docking Simulations. - P. Bernát Szabó; Francesc Sabanés Zariquiey; Juan J. Nogueira (J. Chem. Inf. Model., 2021)

Divide and Conquer. Pocket-Opening Mixed-Solvent Simulations in the Perspective of Docking Virtual Screening Applications for Drug Discovery. - Francesc Sabanés Zariquiey; Edgar Jacoby; Ann Vos; Herman W. T. van Vlijmen; Gary Tresadern; Jeremy N. Harvey (J. Chem. Inf. Model., 2022)

Validation of the Alchemical Transfer Method for the Estimation of Relative Binding Affinities of Molecular Series. - Francesc Sabanés Zariquiey; Adrià Pérez; Maciej Majewski; Emilio Gallicchio; Gianni De Fabritiis (J. Chem. Inf. Model., 2023)

Enhancing Protein-Ligand Binding Affinity Predictions Using Neural Network Potentials. - Francesc Sabanés Zariquiey; Raimondas Galvelis; Emilio Gallicchio; John D. Chodera; Thomas E. Markland; Gianni De Fabritiis (J. Chem. Inf. Model., 2024)

QuantumBind-RBFE: Accurate Relative Binding Free Energy Calculations Using Neural Network Potentials. - Francesc Sabanés Zariquiey; Stephen E. Farr; Stefan Doerr; Gianni De Fabritiis (J. Chem. Inf. Model., 2025)