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2023 | 2 |
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Page 1
Molecular Basis of the Electron Bifurcation Mechanism in the [FeFe]-Hydrogenase Complex HydABC.
J Am Chem Soc. 2023 Mar 15;145(10):5696-5709. doi: 10.1021/jacs.2c11683. Epub 2023 Feb 22.
J Am Chem Soc. 2023.
PMID: 36811855
Free PMC article.
Quinone Catalysis Modulates Proton Transfer Reactions in the Membrane Domain of Respiratory Complex I.
Kim H, Saura P, Pöverlein MC, Gamiz-Hernandez AP, Kaila VRI.
Kim H, et al. Among authors: poverlein mc.
J Am Chem Soc. 2023 Aug 9;145(31):17075-17086. doi: 10.1021/jacs.3c03086. Epub 2023 Jul 25.
J Am Chem Soc. 2023.
PMID: 37490414
Free PMC article.
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Functional Water Wires Catalyze Long-Range Proton Pumping in the Mammalian Respiratory Complex I.
Röpke M, Saura P, Riepl D, Pöverlein MC, Kaila VRI.
Röpke M, et al. Among authors: poverlein mc.
J Am Chem Soc. 2020 Dec 30;142(52):21758-21766. doi: 10.1021/jacs.0c09209. Epub 2020 Dec 16.
J Am Chem Soc. 2020.
PMID: 33325238
Free PMC article.
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QM/MM Free Energy Calculations of Long-Range Biological Protonation Dynamics by Adaptive and Focused Sampling.
Pöverlein MC, Hulm A, Dietschreit JCB, Kussmann J, Ochsenfeld C, Kaila VRI.
Pöverlein MC, et al.
J Chem Theory Comput. 2024 May 8. doi: 10.1021/acs.jctc.4c00199. Online ahead of print.
J Chem Theory Comput. 2024.
PMID: 38718352
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