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Journal of Hazardous Materials
|
April 24, 2026
Computationally predicted persistence of micro- and nanoplastics: Decay of polyethylene terephthalate in neutral, acidic and alkaline media
Szymon Zdybel, Leonid Gorb, Michal Kalapus, et al.
Journal of Computational Chemistry
|
May 5, 2011
Toward robust computational electrochemical predicting the environmental fate of organic pollutants
Liudmila Sviatenko, Olexandr Isayev, Leonid Gorb, et al.
The Journal of Physical Chemistry. A
|
March 20, 2009
Homonuclear versus heteronuclear resonance-assisted hydrogen bonds: tautomerism, aromaticity, and intramolecular hydrogen bonding in heterocyclic systems with different exocyclic proton donor/acceptor
Roman I Zubatyuk, Oleg V Shishkin, Leonid Gorb, et al.
The Journal of Physical Chemistry. B
|
December 16, 2014
Structural waters in the minor and major grooves of DNA--a major factor governing structural adjustments of the A-T mini-helix
Tetiana Zubatiuk, Oleg Shishkin, Leonid Gorb, et al.
Journal of Molecular Modeling
|
September 27, 2017
d(A)<sub>3</sub>d(T)<sub>3</sub> and d(G)<sub>3</sub>d(C)<sub>3</sub> B-DNA mini-helixes: the DFT/M06-2x and DFT/B97-D3 comparison of geometrical and energetic characteristics
Leonid Gorb, Tatiana A Zubatiuk, Roman Zubatyuk, et al.
The Journal of Physical Chemistry. B
|
April 24, 2007
Determination of redox potentials for the Watson-Crick base pairs, DNA nucleosides, and relevant nucleoside analogues
Carlos E Crespo-Hernandez, David M Close, Leonid Gorb, et al.
The Journal of Physical Chemistry. A
|
April 12, 2008
Theoretical elucidation of conflicting experimental data on vertical ionization potentials of microhydrated thymine
David M Close, Carlos E Crespo-Hernández, Leonid Gorb, et al.
The Journal of Physical Chemistry. B
|
July 21, 2006
Thermodynamics and kinetics of intramolecular proton transfer in Guanine. Post Hartree-Fock study
Leonid Gorb, Anna Kaczmarek, Anastasiya Gorb, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 1, 2010
Hydration of nucleic acid bases: a Car-Parrinello molecular dynamics approach
Al'ona Furmanchuk, Olexandr Isayev, Oleg V Shishkin, et al.
The Journal of Physical Chemistry. B
|
December 12, 2007
Tautomeric equilibrium, stability, and hydrogen bonding in 2'-deoxyguanosine monophosphate complexed with Mg2+
Dmytro Kosenkov, Leonid Gorb, Oleg V Shishkin, et al.
Page
of 9
Search research articles
Search
Showing results (31-40 of 89) with videos related to
Sort By:
Page
of 9
Journal of Hazardous Materials
|
April 24, 2026
Computationally predicted persistence of micro- and nanoplastics: Decay of polyethylene terephthalate in neutral, acidic and alkaline media
Szymon Zdybel, Leonid Gorb, Michal Kalapus, et al.
Journal of Computational Chemistry
|
May 5, 2011
Toward robust computational electrochemical predicting the environmental fate of organic pollutants
Liudmila Sviatenko, Olexandr Isayev, Leonid Gorb, et al.
The Journal of Physical Chemistry. A
|
March 20, 2009
Homonuclear versus heteronuclear resonance-assisted hydrogen bonds: tautomerism, aromaticity, and intramolecular hydrogen bonding in heterocyclic systems with different exocyclic proton donor/acceptor
Roman I Zubatyuk, Oleg V Shishkin, Leonid Gorb, et al.
The Journal of Physical Chemistry. B
|
December 16, 2014
Structural waters in the minor and major grooves of DNA--a major factor governing structural adjustments of the A-T mini-helix
Tetiana Zubatiuk, Oleg Shishkin, Leonid Gorb, et al.
Journal of Molecular Modeling
|
September 27, 2017
d(A)<sub>3</sub>d(T)<sub>3</sub> and d(G)<sub>3</sub>d(C)<sub>3</sub> B-DNA mini-helixes: the DFT/M06-2x and DFT/B97-D3 comparison of geometrical and energetic characteristics
Leonid Gorb, Tatiana A Zubatiuk, Roman Zubatyuk, et al.
The Journal of Physical Chemistry. B
|
April 24, 2007
Determination of redox potentials for the Watson-Crick base pairs, DNA nucleosides, and relevant nucleoside analogues
Carlos E Crespo-Hernandez, David M Close, Leonid Gorb, et al.
The Journal of Physical Chemistry. A
|
April 12, 2008
Theoretical elucidation of conflicting experimental data on vertical ionization potentials of microhydrated thymine
David M Close, Carlos E Crespo-Hernández, Leonid Gorb, et al.
The Journal of Physical Chemistry. B
|
July 21, 2006
Thermodynamics and kinetics of intramolecular proton transfer in Guanine. Post Hartree-Fock study
Leonid Gorb, Anna Kaczmarek, Anastasiya Gorb, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 1, 2010
Hydration of nucleic acid bases: a Car-Parrinello molecular dynamics approach
Al'ona Furmanchuk, Olexandr Isayev, Oleg V Shishkin, et al.
The Journal of Physical Chemistry. B
|
December 12, 2007
Tautomeric equilibrium, stability, and hydrogen bonding in 2'-deoxyguanosine monophosphate complexed with Mg2+
Dmytro Kosenkov, Leonid Gorb, Oleg V Shishkin, et al.
Page
of 9