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Leonid Gorb

Showing results (1-10 of 89) with videos related to

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Journal of Molecular Modeling|February 18, 2017
Can Fe<sup>3+</sup> and Al<sup>3+</sup> ions serve as cationic bridges to facilitate the adsorption of anionic As(V) species on humic acids? A density functional theory studyLeonid Gorb, Manoj K Shukla
The Journal of Physical Chemistry. A|July 13, 2006
Rare tautomer hypothesis supported by theoretical studies: ab initio investigations of prototropic tautomerism in the N-methyl-p baseYevgeniy Podolyan, Leonid Gorb, Jerzy Leszczynski
The Journal of Physical Chemistry. A|November 19, 2024
Role of Hydroxyl Radical in the Degradation of ATO: DFT StudyLiudmyla Sviatenko, Leonid Gorb, Jerzy Leszczynski
Journal of Computational Chemistry|March 7, 2007
Theoretical calculations: can Gibbs free energy for intermolecular complexes be predicted efficiently and accurately?Olexandr Isayev, Leonid Gorb, Jerzy Leszczynski
Journal of Molecular Modeling|June 27, 2020
A density functional theory study of simplest nanocomposites formed by graphene oxide and polyvinyl alcohol: geometry, interaction energy and vibrational spectrumLeonid Gorb, Mykola Ilchenko, Jerzy Leszczynski
Environmental Science and Pollution Research International|May 11, 2022
Decomposition of 2,4,6-trinitrotoluene (TNT) and 5-nitro-2,4-dihydro-3H-1,2,4-triazol-3-one (NTO) by Fe<sub>13</sub>O<sub>13</sub> nanoparticle: density functional theory studyLeonid Gorb, Mykola Ilchenko, Jerzy Leszczynski
Journal of Biomolecular Structure & Dynamics|December 14, 2004
Charges of phosphate groups. A role in stabilization of 2'-deoxyribonucleotides. A DFT investigationLeonid Gorb, Oleg Shishkin, Jerzy Leszczynski
BBA Advances|April 21, 2023
The structure of DNA fragments: Quantum-chemical modellingLeonid Gorb, Oleg V Shishkin, Tetiana Zubatiuk
Physical Chemistry Chemical Physics : PCCP|December 12, 2023
Degradation of NTO induced by superoxide and hydroperoxyl radicals: a comprehensive DFT studyLiudmyla K Sviatenko, Leonid Gorb, Jerzy Leszczynski
The Journal of Physical Chemistry. A|October 5, 2023
Role of Hydroxyl Radical in Degradation of NTO: DFT StudyLiudmyla K Sviatenko, Leonid Gorb, Jerzy Leszczynski
Pageof 9

Showing results (1-10 of 89) with videos related to

Sort By:
Pageof 9
Journal of Molecular Modeling|February 18, 2017
Can Fe<sup>3+</sup> and Al<sup>3+</sup> ions serve as cationic bridges to facilitate the adsorption of anionic As(V) species on humic acids? A density functional theory studyLeonid Gorb, Manoj K Shukla
The Journal of Physical Chemistry. A|July 13, 2006
Rare tautomer hypothesis supported by theoretical studies: ab initio investigations of prototropic tautomerism in the N-methyl-p baseYevgeniy Podolyan, Leonid Gorb, Jerzy Leszczynski
The Journal of Physical Chemistry. A|November 19, 2024
Role of Hydroxyl Radical in the Degradation of ATO: DFT StudyLiudmyla Sviatenko, Leonid Gorb, Jerzy Leszczynski
Journal of Computational Chemistry|March 7, 2007
Theoretical calculations: can Gibbs free energy for intermolecular complexes be predicted efficiently and accurately?Olexandr Isayev, Leonid Gorb, Jerzy Leszczynski
Journal of Molecular Modeling|June 27, 2020
A density functional theory study of simplest nanocomposites formed by graphene oxide and polyvinyl alcohol: geometry, interaction energy and vibrational spectrumLeonid Gorb, Mykola Ilchenko, Jerzy Leszczynski
Environmental Science and Pollution Research International|May 11, 2022
Decomposition of 2,4,6-trinitrotoluene (TNT) and 5-nitro-2,4-dihydro-3H-1,2,4-triazol-3-one (NTO) by Fe<sub>13</sub>O<sub>13</sub> nanoparticle: density functional theory studyLeonid Gorb, Mykola Ilchenko, Jerzy Leszczynski
Journal of Biomolecular Structure & Dynamics|December 14, 2004
Charges of phosphate groups. A role in stabilization of 2'-deoxyribonucleotides. A DFT investigationLeonid Gorb, Oleg Shishkin, Jerzy Leszczynski
BBA Advances|April 21, 2023
The structure of DNA fragments: Quantum-chemical modellingLeonid Gorb, Oleg V Shishkin, Tetiana Zubatiuk
Physical Chemistry Chemical Physics : PCCP|December 12, 2023
Degradation of NTO induced by superoxide and hydroperoxyl radicals: a comprehensive DFT studyLiudmyla K Sviatenko, Leonid Gorb, Jerzy Leszczynski
The Journal of Physical Chemistry. A|October 5, 2023
Role of Hydroxyl Radical in Degradation of NTO: DFT StudyLiudmyla K Sviatenko, Leonid Gorb, Jerzy Leszczynski
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