Very proud of our work that took us more than 10 years that just got published! We learned a lot in the process about modelling H transfer reactions.

This work is a colaboration with Damien Laage, Casey Hynes, Elise Duboué-Dijon, José Javier Ruiz-Pernía and more. Check it out! (https://pubs.aip.org/aip/jcp/article-abstract/162/12/124118/3341220/Molecular-dynamics-simulations-for-enzymatic?redirectedFrom=fulltext)