Elucidation of the Active Form and Reaction Mechanism in Human Asparaginase Type III Using Multiscale Simulations. - Milorad Andjelkovic; Kirill Zinovjev; Carlos Alberto Ramos-Guzmán; Jose Javier Ruiz-Pernía; Iñaki Tuñón (J. Chem. Inf. Model., 2023)

Understanding the Interactions of Ubiquitin-Specific Protease 7 with Its Substrates through Molecular Dynamics Simulations: Insights into the Role of Its C-Terminal Domains in Substrate Recognition. - José Luis Velázquez-Libera; Julio Caballero; Jans H. Alzate-Morales; Jose Javier Ruiz-Pernía; Iñaki Tuñón (J. Chem. Inf. Model., 2024)