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Journal of the American Chemical Society
|
July 11, 2013
First-principles characterization of the energy landscape and optical spectra of green fluorescent protein along the A→I→B proton transfer route
Bella L Grigorenko, Alexander V Nemukhin, Igor V Polyakov, et al.
International Journal of Molecular Sciences
|
September 13, 2025
Mechanism for Nucleotidyl Transfer in LINE-1 ORF2p Revealed by QM/MM Simulations
Igor V Polyakov, Kirill D Miroshnichenko, Tatiana I Mulashkina, et al.
The Journal of Physical Chemistry. B
|
April 14, 2015
A Light-Induced Reaction with Oxygen Leads to Chromophore Decomposition and Irreversible Photobleaching in GFP-Type Proteins
Bella L Grigorenko, Alexander V Nemukhin, Igor V Polyakov, et al.
Molecular Informatics
|
October 19, 2022
Quantum-based Modeling of Protein-ligand Interaction: The Complex of RutA with Uracil and Molecular Oxygen
Igor V Polyakov, Alexander V Nemukhin, Tatiana M Domratcheva, et al.
The Journal of Physical Chemistry. B
|
January 7, 2021
Interplay between Locally Excited and Charge Transfer States Governs the Photoswitching Mechanism in the Fluorescent Protein Dreiklang
Tirthendu Sen, Yingying Ma, Igor V Polyakov, et al.
Journal of Chemical Theory and Computation
|
November 24, 2015
Toward Molecular-Level Characterization of Photoinduced Decarboxylation of the Green Fluorescent Protein: Accessibility of the Charge-Transfer States
Bella L Grigorenko, Alexander V Nemukhin, Dmitry I Morozov, et al.
Ecological Applications : a Publication of the Ecological Society of America
|
February 22, 2014
Trajectory of the Arctic as an integrated system
Larry D Hinzman, Clara J Deal, A David McGuire, et al.
International Journal of Molecular Sciences
|
June 13, 2025
Substrate Activation Efficiency in Active Sites of Hydrolases Determined by QM/MM Molecular Dynamics and Neural Networks
Igor V Polyakov, Yulia I Meteleshko, Tatiana I Mulashkina, et al.
Ecological Applications : a Publication of the Ecological Society of America
|
February 22, 2014
Recent oceanic changes in the Arctic in the context of long-term observations
Igor V Polyakov, Uma S Bhatt, John E Walsh, et al.
Journal of the American Chemical Society
|
June 9, 2023
Multiscale Simulations of the Covalent Inhibition of the SARS-CoV-2 Main Protease: Four Compounds and Three Reaction Mechanisms
Bella L Grigorenko, Igor V Polyakov, Maria G Khrenova, et al.
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Search research articles
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Showing results (11-20 of 27) with videos related to
Sort By:
Page
of 3
Journal of the American Chemical Society
|
July 11, 2013
First-principles characterization of the energy landscape and optical spectra of green fluorescent protein along the A→I→B proton transfer route
Bella L Grigorenko, Alexander V Nemukhin, Igor V Polyakov, et al.
International Journal of Molecular Sciences
|
September 13, 2025
Mechanism for Nucleotidyl Transfer in LINE-1 ORF2p Revealed by QM/MM Simulations
Igor V Polyakov, Kirill D Miroshnichenko, Tatiana I Mulashkina, et al.
The Journal of Physical Chemistry. B
|
April 14, 2015
A Light-Induced Reaction with Oxygen Leads to Chromophore Decomposition and Irreversible Photobleaching in GFP-Type Proteins
Bella L Grigorenko, Alexander V Nemukhin, Igor V Polyakov, et al.
Molecular Informatics
|
October 19, 2022
Quantum-based Modeling of Protein-ligand Interaction: The Complex of RutA with Uracil and Molecular Oxygen
Igor V Polyakov, Alexander V Nemukhin, Tatiana M Domratcheva, et al.
The Journal of Physical Chemistry. B
|
January 7, 2021
Interplay between Locally Excited and Charge Transfer States Governs the Photoswitching Mechanism in the Fluorescent Protein Dreiklang
Tirthendu Sen, Yingying Ma, Igor V Polyakov, et al.
Journal of Chemical Theory and Computation
|
November 24, 2015
Toward Molecular-Level Characterization of Photoinduced Decarboxylation of the Green Fluorescent Protein: Accessibility of the Charge-Transfer States
Bella L Grigorenko, Alexander V Nemukhin, Dmitry I Morozov, et al.
Ecological Applications : a Publication of the Ecological Society of America
|
February 22, 2014
Trajectory of the Arctic as an integrated system
Larry D Hinzman, Clara J Deal, A David McGuire, et al.
International Journal of Molecular Sciences
|
June 13, 2025
Substrate Activation Efficiency in Active Sites of Hydrolases Determined by QM/MM Molecular Dynamics and Neural Networks
Igor V Polyakov, Yulia I Meteleshko, Tatiana I Mulashkina, et al.
Ecological Applications : a Publication of the Ecological Society of America
|
February 22, 2014
Recent oceanic changes in the Arctic in the context of long-term observations
Igor V Polyakov, Uma S Bhatt, John E Walsh, et al.
Journal of the American Chemical Society
|
June 9, 2023
Multiscale Simulations of the Covalent Inhibition of the SARS-CoV-2 Main Protease: Four Compounds and Three Reaction Mechanisms
Bella L Grigorenko, Igor V Polyakov, Maria G Khrenova, et al.
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