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Year | Number of Results |
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2011 | 1 |
2012 | 1 |
2013 | 1 |
2015 | 2 |
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Chloroperoxidase-Catalyzed Epoxidation of Cis-β-Methylstyrene: NH-S Hydrogen Bonds and Proximal Helix Dipole Change the Catalytic Mechanism and Significantly Lower the Reaction Barrier.
J Phys Chem B. 2015 Nov 12;119(45):14350-63. doi: 10.1021/acs.jpcb.5b06731. Epub 2015 Nov 3.
J Phys Chem B. 2015.
PMID: 26452587
Proximal Pocket Hydrogen Bonds Significantly Influence the Mechanism of Chloroperoxidase Compound I Formation.
Pardillo AD, Morozov AN, Chatfield DC.
Pardillo AD, et al.
J Phys Chem B. 2015 Oct 1;119(39):12590-602. doi: 10.1021/acs.jpcb.5b06324. Epub 2015 Sep 18.
J Phys Chem B. 2015.
PMID: 26339752
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Theoretical study of HOCl-catalyzed keto-enol tautomerization of β-cyclopentanedione in an explicit water environment.
D'Cunha C, Morozov AN, Chatfield DC.
D'Cunha C, et al.
J Phys Chem A. 2013 Sep 5;117(35):8437-48. doi: 10.1021/jp401409y. Epub 2013 Aug 22.
J Phys Chem A. 2013.
PMID: 23902476
Free PMC article.
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Chloroperoxidase-catalyzed epoxidation of cis-β-methylstyrene: distal pocket flexibility tunes catalytic reactivity.
Morozov AN, Chatfield DC.
Morozov AN, et al.
J Phys Chem B. 2012 Nov 1;116(43):12905-14. doi: 10.1021/jp302763h. Epub 2012 Oct 19.
J Phys Chem B. 2012.
PMID: 23020548
Free PMC article.
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Enantiospecificity of chloroperoxidase-catalyzed epoxidation: biased molecular dynamics study of a cis-β-methylstyrene/chloroperoxidase-compound I complex.
Morozov AN, D'Cunha C, Alvarez CA, Chatfield DC.
Morozov AN, et al.
Biophys J. 2011 Feb 16;100(4):1066-75. doi: 10.1016/j.bpj.2010.12.3729.
Biophys J. 2011.
PMID: 21320452
Free PMC article.
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