A Possible Mechanism for Redox Control of Human Neuroglobin Activity
Morozov, Alexander N, Roach, James P, Kotzer, Margarita, Chatfield, David C
Published in Journal of chemical information and modeling (28.07.2014)
Published in Journal of chemical information and modeling (28.07.2014)
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Journal Article
1,3-Dipolar Cycloadditions of Trimethylsilyldiazomethane Revisited: Steric Demand of the Dipolarophile and the Influence on Product Distribution
Simovic, Dragan, Di, Mingping, Marks, Vered, Chatfield, David C, Rein, Kathleen S
Published in Journal of organic chemistry (19.01.2007)
Published in Journal of organic chemistry (19.01.2007)
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Journal Article
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
Morozov, Alexander N, Pardillo, Armando D, Chatfield, David C
Published in The journal of physical chemistry. B (12.11.2015)
Published in The journal of physical chemistry. B (12.11.2015)
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Journal Article
Theoretical Study of HOCl-Catalyzed Keto–Enol Tautomerization of β‑Cyclopentanedione in an Explicit Water Environment
D’Cunha, Cassian, Morozov, Alexander N, Chatfield, David C
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (05.09.2013)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (05.09.2013)
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Journal Article
Enantiospecificity of Chloroperoxidase-Catalyzed Epoxidation: Biased Molecular Dynamics Study of a Cis- β-Methylstyrene/Chloroperoxidase-Compound I Complex
Morozov, Alexander N., D'Cunha, Cassian, Alvarez, Carlos A., Chatfield, David C.
Published in Biophysical journal (16.02.2011)
Published in Biophysical journal (16.02.2011)
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Journal Article
The conformation of end-groups is one determinant of carotenoid topology suitable for high fidelity molecular recognition: A study of β- and ε-end-groups
Landrum, John T., Chatfield, David C., Mebel, Alex M., Alvarez-Calderon, Francesca, Fernandez, Melissa V.
Published in Archives of biochemistry and biophysics (15.01.2010)
Published in Archives of biochemistry and biophysics (15.01.2010)
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Journal Article
Correlation times and adiabatic barriers for methyl rotation in SNase
Chatfield, David C, Augsten, Alberto, D'Cunha, Cassian
Published in Journal of biomolecular NMR (01.07.2004)
Published in Journal of biomolecular NMR (01.07.2004)
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Journal Article
Control of chemical reactivity by quantized transition states
Chatfield, David C, Friedman, Ronald S, Schwenke, David W, Truhlar, Donald G
Published in Journal of physical chemistry (1952) (01.03.1992)
Published in Journal of physical chemistry (1952) (01.03.1992)
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Journal Article
Methyl dynamics in crystalline amino acids: MD and NMR
Chatfield, David C., Augsten, Alberto, D'Cunha, Cassian, Wong, Sergio E.
Published in Journal of computational chemistry (15.07.2003)
Published in Journal of computational chemistry (15.07.2003)
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Journal Article
HIV-1 Protease Cleavage Mechanism Elucidated with Molecular Dynamics Simulation
Chatfield, David C, Brooks, Bernard R
Published in Journal of the American Chemical Society (01.05.1995)
Published in Journal of the American Chemical Society (01.05.1995)
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Journal Article
Correction
Morozov, Alexander N., D'Cunha, Cassian, Alvarez, Carlos A., Chatfield, David C.
Published in Biophysical journal (16.03.2011)
Published in Biophysical journal (16.03.2011)
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Journal Article
Correction
Morozov, Alexander N., D'Cunha, Cassian, Alvarez, Carlos A., Chatfield, David C.
Published in Biophysical journal (01.03.2011)
Published in Biophysical journal (01.03.2011)
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Journal Article