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Katherina Murcek
Graduate Student
2022-
B.Sc (Hons.) in Chemistry, University of Pittsburgh (2018-2022)
Katherina’s research utilizes computational chemistry to elucidate reaction mechanisms and important substrate-enzyme interactions in metalloredox radical biocatalytic reactions.
Research Interest
My research leverages state of the art computational methods, include Density Functional Theory (DFT) and classical Molecular Dynamics (MD) to elucidate reaction mechanisms, substrate-enzyme interactions and other important insights focusing on Understanding the enantio- and chemoselectivity of metalloredox radical biocatalysis in engineered enzymes
Publications in the Liu Group
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