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The Journal of Physical Chemistry. B
|
August 4, 2022
NTO Degradation by Nitroreductase: A DFT Study
Liudmyla K Sviatenko, Leonid Gorb, Jerzy Leszczynski
The Journal of Physical Chemistry. A
|
July 29, 2024
5-Amino-1,2,4-triazol-3-one Degradation by Indirect Photolysis: A Density Functional Theory Study
Liudmyla K Sviatenko, Leonid Gorb, Jerzy Leszczynski
The Journal of Physical Chemistry. A
|
March 20, 2023
Role of Molecular Singlet Oxygen in Photochemical Degradation of NTO: DFT Study
Liudmyla K Sviatenko, Leonid Gorb, Jerzy Leszczynski
Molecular Diversity
|
May 20, 2006
Structure-toxicity relationships of nitroaromatic compounds
Olexandr Isayev, Bakhtiyor Rasulev, Leonid Gorb, et al.
The Journal of Physical Chemistry. A
|
May 22, 2008
Computational study of the aminolysis of anhydrides: effect of the catalysis to the reaction of succinic anhydride with methylamine in gas phase and nonpolar solution
Tetyana Petrova, Sergiy Okovytyy, Leonid Gorb, et al.
The Journal of Physical Chemistry. A
|
February 10, 2012
Interaction of 2'-deoxyadenosine with cis-2-butene-1,4-dial: computational approach to analysis of multistep chemical reactions
Liudmyla Sviatenko, Leonid Gorb, Dmytro Hovorun, et al.
The Journal of Physical Chemistry. B
|
August 9, 2008
Ab initio molecular dynamics study on the initial chemical events in nitramines: thermal decomposition of CL-20
Olexandr Isayev, Leonid Gorb, Mo Qasim, et al.
The Journal of Physical Chemistry. A
|
April 20, 2007
Electronic structure and bonding of {Fe(PhNO2)}6 complexes: a density functional theory study
Olexandr Isayev, Leonid Gorb, Igor Zilberberg, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
November 10, 2022
Manifestations of intramolecular H-bonds of CH… O and OH… C type in quercetin molecule: Analysis of IR spectra by mean of density functional theory
Dmytro M Hovorun, Ivan S Voiteshenko, Leonid Gorb
Journal of Biomolecular Structure & Dynamics
|
January 6, 2018
Diffusion of energetic compounds through biological membrane: Application of classical MD and COSMOmic approximations
Anastasiia Golius, Leonid Gorb, Olexander Isayev, et al.
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Search research articles
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Showing results (11-20 of 89) with videos related to
Sort By:
Page
of 9
The Journal of Physical Chemistry. B
|
August 4, 2022
NTO Degradation by Nitroreductase: A DFT Study
Liudmyla K Sviatenko, Leonid Gorb, Jerzy Leszczynski
The Journal of Physical Chemistry. A
|
July 29, 2024
5-Amino-1,2,4-triazol-3-one Degradation by Indirect Photolysis: A Density Functional Theory Study
Liudmyla K Sviatenko, Leonid Gorb, Jerzy Leszczynski
The Journal of Physical Chemistry. A
|
March 20, 2023
Role of Molecular Singlet Oxygen in Photochemical Degradation of NTO: DFT Study
Liudmyla K Sviatenko, Leonid Gorb, Jerzy Leszczynski
Molecular Diversity
|
May 20, 2006
Structure-toxicity relationships of nitroaromatic compounds
Olexandr Isayev, Bakhtiyor Rasulev, Leonid Gorb, et al.
The Journal of Physical Chemistry. A
|
May 22, 2008
Computational study of the aminolysis of anhydrides: effect of the catalysis to the reaction of succinic anhydride with methylamine in gas phase and nonpolar solution
Tetyana Petrova, Sergiy Okovytyy, Leonid Gorb, et al.
The Journal of Physical Chemistry. A
|
February 10, 2012
Interaction of 2'-deoxyadenosine with cis-2-butene-1,4-dial: computational approach to analysis of multistep chemical reactions
Liudmyla Sviatenko, Leonid Gorb, Dmytro Hovorun, et al.
The Journal of Physical Chemistry. B
|
August 9, 2008
Ab initio molecular dynamics study on the initial chemical events in nitramines: thermal decomposition of CL-20
Olexandr Isayev, Leonid Gorb, Mo Qasim, et al.
The Journal of Physical Chemistry. A
|
April 20, 2007
Electronic structure and bonding of {Fe(PhNO2)}6 complexes: a density functional theory study
Olexandr Isayev, Leonid Gorb, Igor Zilberberg, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
November 10, 2022
Manifestations of intramolecular H-bonds of CH… O and OH… C type in quercetin molecule: Analysis of IR spectra by mean of density functional theory
Dmytro M Hovorun, Ivan S Voiteshenko, Leonid Gorb
Journal of Biomolecular Structure & Dynamics
|
January 6, 2018
Diffusion of energetic compounds through biological membrane: Application of classical MD and COSMOmic approximations
Anastasiia Golius, Leonid Gorb, Olexander Isayev, et al.
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of 9