Brunner syndrome caused by point mutation explained by multiscale simulation of enzyme reaction

por Prah, Alja, Pregeljc, Domen, Stare, Jernej, Mavri, Janez
Publicado 2022

Hydride Abstraction as the Rate-Limiting Step of the Irreversible Inhibition of Monoamine Oxidase B by Rasagiline and Selegiline: A Computational Empirical Valence Bond Study

por Tandarić, Tana, Prah, Alja, Stare, Jernej, Mavri, Janez, Vianello, Robert
Publicado 2020

How Monoamine Oxidase A Decomposes Serotonin: An Empirical Valence Bond Simulation of the Reactive Step

por Prah, Alja, Purg, Miha, Stare, Jernej, Vianello, Robert, Mavri, Janez
Publicado 2020

Path Integral Calculation of the Hydrogen/Deuterium Kinetic Isotope Effect in Monoamine Oxidase A-Catalyzed Decomposition of Benzylamine

por Brela, Mateusz Z., Prah, Alja, Boczar, Marek, Stare, Jernej, Mavri, Janez
Publicado 2019

Computational Insights into β-Carboline Inhibition of Monoamine Oxidase A

por Prah, Alja, Gavranić, Tanja, Perdih, Andrej, Sollner Dolenc, Marija, Mavri, Janez
Publicado 2022