An integrated in silico screening strategy for identifying promising disruptors of p53-MDM2 interaction. - Hajar Sirous; Giulia Chemi; Giuseppe Campiani; Simone Brogi (Comput. Biol. Chem., 2019)

Discovery of novel hit compounds as potential HDAC1 inhibitors: The case of ligand- and structure-based virtual screening. - Hajar Sirous; Giuseppe Campiani; Vincenzo Calderone; Simone Brogi (Comput. Biol. Medicine, 2021)

In Silico Analysis of Peptide-Based Derivatives Containing Bifunctional Warheads Engaging Prime and Non-Prime Subsites to Covalent Binding SARS-CoV-2 Main Protease (Mpro). - Simone Brogi; Sara Rossi; Roberta Ibba; Stefania Butini; Vincenzo Calderone; Giuseppe Campiani; Sandra Gemma (Comput., 2022)