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Journal of Computational Chemistry|October 23, 2009
A compound QM/MM procedure: comparative performance on a pyruvate formate-lyase model systemKarmen Condic-Jurkic, Hendrik Zipse, David M SmithJournal of Chemical Theory and Computation|November 24, 2015
The Protonation States of the Active-Site Histidines in (6-4) PhotolyaseKarmen Condic-Jurkic, Ana-Sunčana Smith, Hendrik Zipse, et al.Neurochemistry International|May 16, 2016
Structural and dynamic perspectives on the promiscuous transport activity of P-glycoproteinNandhitha Subramanian, Karmen Condic-Jurkic, Megan L O'MaraJournal of Chemical Information and Modeling|May 5, 2015
Identification of Possible Binding Sites for Morphine and Nicardipine on the Multidrug Transporter P-Glycoprotein Using Umbrella Sampling TechniquesNandhitha Subramanian, Karmen Condic-Jurkic, Alan E Mark, et al.Plos One|January 26, 2018
The reliability of molecular dynamics simulations of the multidrug transporter P-glycoprotein in a membrane environmentKarmen Condic-Jurkic, Nandhitha Subramanian, Alan E Mark, et al.Biochemistry|December 14, 2016
Hydrophobic Shielding Drives Catalysis of Hydride Transfer in a Family of F<sub>420</sub>H<sub>2</sub>-Dependent EnzymesA Elaaf Mohamed, Karmen Condic-Jurkic, F Hafna Ahmed, et al.Protein Science : a Publication of the Protein Society|July 2, 2016
Rv2074 is a novel F420 H2 -dependent biliverdin reductase in Mycobacterium tuberculosisF Hafna Ahmed, A Elaaf Mohamed, Paul D Carr, et al.Journal of Computational Chemistry|April 30, 2008
On the modeling of arginine-bound carboxylates: a case study with Pyruvate Formate-LyaseKarmen Condić-Jurkić, V Tamara Perchyonok, Hendrik Zipse, et al.Organic & Biomolecular Chemistry|August 22, 2003
The influence of hydrogen bonding interactions on the C-H bond activation step in class I ribonucleotide reductasesHendrik ZipsePhysical Chemistry Chemical Physics : PCCP|February 12, 2011
Theoretical studies of 31P NMR spectral properties of phosphanes and related compounds in solutionBoris Maryasin, Hendrik ZipsePageof 39