Post-Translational Regulation of CYP450s Metabolism As Revealed by All-Atoms Simulations of the Aromatase Enzyme. - Ida Ritacco; Angelo Spinello; Emiliano Ippoliti; Alessandra Magistrato (J. Chem. Inf. Model., 2019)

How Can Interleukin-1 Receptor Antagonist Modulate Distinct Cell Death Pathways? - Angelo Spinello; Elena Vecile; Antonio Abbate; Aldo Dobrina; Alessandra Magistrato (J. Chem. Inf. Model., 2019)

Exploiting Cryo-EM Structural Information and All-Atom Simulations To Decrypt the Molecular Mechanism of Splicing Modulators. - Jure Borisek; Andrea Saltalamacchia; Angelo Spinello; Alessandra Magistrato (J. Chem. Inf. Model., 2020)

Molecular Mechanisms of the Blockage of Glioblastoma Motility. - Jing Xu; Federica Simonelli; Xiaoyun Li; Angelo Spinello; Sara Laporte; Vincent Torre; Alessandra Magistrato (J. Chem. Inf. Model., 2021)