Ligand Pose Predictions for Human G Protein-Coupled Receptors: Insights from the Amber-Based Hybrid Molecular Mechanics/Coarse-Grained Approach. - Jakob Schneider; Ksenia Korshunova; Zeineb Si Chaib; Alejandro Giorgetti; Mercedes Alfonso-Prieto; Paolo Carloni (J. Chem. Inf. Model., 2020)

Machine Learning-Based Modeling of Olfactory Receptors in Their Inactive State: Human OR51E2 as a Case Study. - Mercedes Alfonso-Prieto; Riccardo Capelli (J. Chem. Inf. Model., 2023)

Calcium-Driven In Silico Inactivation of a Human Olfactory Receptor. - Lorenza Pirona; Federico Ballabio; Mercedes Alfonso-Prieto; Riccardo Capelli (J. Chem. Inf. Model., 2024)