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Journal of the American Chemical Society|January 22, 2014
Assigning the EPR fine structure parameters of the Mn(II) centers in Bacillus subtilis oxalate decarboxylase by site-directed mutagenesis and DFT/MM calculationsPablo Campomanes, Whitney F Kellett, Lindsey M Easthon, et al.
Chemistry of Materials : a Publication of the American Chemical Society|October 30, 2020
Structural and Photophysical Templating of Conjugated Polyelectrolytes with Single-Stranded DNALisa Peterhans, Eliana Nicolaidou, Polydefkis Diamantis, et al.
Inorganic Chemistry|December 14, 2011
Acid-induced degradation of phosphorescent dopants for OLEDs and its application to the synthesis of tris-heteroleptic iridium(III) bis-cyclometalated complexesEtienne Baranoff, Basile F E Curchod, Julien Frey, et al.
Biochemistry|September 18, 2008
The conformational flexibility of the carboxy terminal residues 105-114 is a key modulator of the catalytic activity and stability of macrophage migration inhibitory factorFarah El-Turk, Michele Cascella, Hajer Ouertatani-Sakouhi, et al.
Journal of Chemical Information and Modeling|February 22, 2023
MiMiCPy: An Efficient Toolkit for MiMiC-Based QM/MM SimulationsBharath Raghavan, Florian K Schackert, Andrea Levy, et al.
Biochemistry|March 5, 2013
Computational, structural, and kinetic evidence that Vibrio vulnificus FrsA is not a cofactor-independent pyruvate decarboxylaseWhitney F Kellett, Elizabeth Brunk, Bijoy J Desai, et al.
Inorganic Chemistry|January 7, 2012
Influence of halogen atoms on a homologous series of bis-cyclometalated iridium(III) complexesEtienne Baranoff, Basile F E Curchod, Filippo Monti, et al.
ACS Energy Letters|August 22, 2022
Interplay of Kinetic and Thermodynamic Reaction Control Explains Incorporation of Dimethylammonium Iodide into CsPbI<sub>3</sub>Aditya Mishra, Dominik J Kubicki, Ariadni Boziki, et al.
Structural Dynamics (Melville, N.Y.)|January 9, 2018
Charge separation and carrier dynamics in donor-acceptor heterojunction photovoltaic systemsJoël Teuscher, Jan C Brauer, Andrey Stepanov, et al.
The Journal of Physical Chemistry Letters|June 14, 2019
Ruddlesden-Popper Phases of Methylammonium-Based Two-Dimensional Perovskites with 5-Ammonium Valeric Acid AVA<sub>2</sub>MA <sub>n-1</sub>Pb <sub>n</sub>I<sub>3 n+1</sub> with n = 1, 2, and 3Negar Ashari-Astani, Farzaneh Jahanbakhshi, Marko Mladenović, et al.
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