Jove
Visualize
Contact Us
JoVE
x logofacebook logolinkedin logoyoutube logo
ABOUT JoVE
OverviewLeadershipBlogJoVE Help Center
AUTHORS
Publishing ProcessEditorial BoardScope & PoliciesPeer ReviewFAQSubmit
LIBRARIANS
TestimonialsSubscriptionsAccessResourcesLibrary Advisory BoardFAQ
RESEARCH
JoVE JournalMethods CollectionsJoVE Encyclopedia of ExperimentsArchive
EDUCATION
JoVE CoreJoVE BusinessJoVE Science EducationJoVE Lab ManualFaculty Resource CenterFaculty Site
Terms & Conditions of Use
Privacy Policy
Policies

Filters

Dmytro Bykov

Showing results (1-10 of 21) with videos related to

Pageof 3
Sort By:
Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|March 29, 2012
Reductive activation of the heme iron-nitrosyl intermediate in the reaction mechanism of cytochrome c nitrite reductase: a theoretical studyDmytro Bykov, Frank Neese
Journal of Computational Chemistry|December 8, 2016
The GPU-enabled divide-expand-consolidate RI-MP2 method (DEC-RI-MP2)Dmytro Bykov, Thomas Kjaergaard
Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|December 3, 2010
Substrate binding and activation in the active site of cytochrome c nitrite reductase: a density functional studyDmytro Bykov, Frank Neese
Inorganic Chemistry|August 4, 2015
Six-electron reduction of nitrite to ammonia by cytochrome c nitrite reductase: insights from density functional theory studiesDmytro Bykov, Frank Neese
Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|November 26, 2013
Heme-bound nitroxyl, hydroxylamine, and ammonia ligands as intermediates in the reaction cycle of cytochrome c nitrite reductase: a theoretical studyDmytro Bykov, Matthias Plog, Frank Neese
The Journal of Chemical Physics|July 17, 2016
The molecular gradient using the divide-expand-consolidate resolution of the identity second-order Møller-Plesset perturbation theory: The DEC-RI-MP2 gradientDmytro Bykov, Kasper Kristensen, Thomas Kjærgaard
The Journal of Physical Chemistry. A|September 13, 2019
Multilayer Divide-Expand-Consolidate Coupled-Cluster Method: Demonstrative Calculations of the Adsorption Energy of Carbon Dioxide in the Mg-MOF-74 Metal-Organic FrameworkAshleigh L Barnes, Dmytro Bykov, Dmitry I Lyakh, et al.
Journal of the American Chemical Society|February 12, 2011
Dynamic hydrogen-bonding network in the distal pocket of the nitrosyl complex of Pseudomonas aeruginosa cd1 nitrite reductaseMarina Radoul, Dmytro Bykov, Serena Rinaldo, et al.
The Journal of Chemical Physics|April 8, 2019
Cluster perturbation theory. III. Perturbation series for coupled cluster singles and doubles excitation energiesPablo Baudin, Filip Pawłowski, Dmytro Bykov, et al.
The Journal of Chemical Physics|March 5, 2025
Benchmarking third-order cluster perturbation theory for electronically excited statesMagnus B Johansen, Hector H Corzo, Andreas E Hillers-Bendtsen, et al.
Pageof 3

Showing results (1-10 of 21) with videos related to

Sort By:
Pageof 3
Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|March 29, 2012
Reductive activation of the heme iron-nitrosyl intermediate in the reaction mechanism of cytochrome c nitrite reductase: a theoretical studyDmytro Bykov, Frank Neese
Journal of Computational Chemistry|December 8, 2016
The GPU-enabled divide-expand-consolidate RI-MP2 method (DEC-RI-MP2)Dmytro Bykov, Thomas Kjaergaard
Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|December 3, 2010
Substrate binding and activation in the active site of cytochrome c nitrite reductase: a density functional studyDmytro Bykov, Frank Neese
Inorganic Chemistry|August 4, 2015
Six-electron reduction of nitrite to ammonia by cytochrome c nitrite reductase: insights from density functional theory studiesDmytro Bykov, Frank Neese
Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|November 26, 2013
Heme-bound nitroxyl, hydroxylamine, and ammonia ligands as intermediates in the reaction cycle of cytochrome c nitrite reductase: a theoretical studyDmytro Bykov, Matthias Plog, Frank Neese
The Journal of Chemical Physics|July 17, 2016
The molecular gradient using the divide-expand-consolidate resolution of the identity second-order Møller-Plesset perturbation theory: The DEC-RI-MP2 gradientDmytro Bykov, Kasper Kristensen, Thomas Kjærgaard
The Journal of Physical Chemistry. A|September 13, 2019
Multilayer Divide-Expand-Consolidate Coupled-Cluster Method: Demonstrative Calculations of the Adsorption Energy of Carbon Dioxide in the Mg-MOF-74 Metal-Organic FrameworkAshleigh L Barnes, Dmytro Bykov, Dmitry I Lyakh, et al.
Journal of the American Chemical Society|February 12, 2011
Dynamic hydrogen-bonding network in the distal pocket of the nitrosyl complex of Pseudomonas aeruginosa cd1 nitrite reductaseMarina Radoul, Dmytro Bykov, Serena Rinaldo, et al.
The Journal of Chemical Physics|April 8, 2019
Cluster perturbation theory. III. Perturbation series for coupled cluster singles and doubles excitation energiesPablo Baudin, Filip Pawłowski, Dmytro Bykov, et al.
The Journal of Chemical Physics|March 5, 2025
Benchmarking third-order cluster perturbation theory for electronically excited statesMagnus B Johansen, Hector H Corzo, Andreas E Hillers-Bendtsen, et al.
Pageof 3