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Molecules (Basel, Switzerland)
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July 26, 2013
In-solution conformational analysis of the XCYCH3 moiety for small esters and ethers with all combinations of X, Y = O, S
Peter I Nagy
Physical Chemistry Chemical Physics : PCCP
|
September 15, 2012
Theoretical study of the gauche-trans equilibrium with and without an intramolecular hydrogen bond for +H3NCH2CH2X systems (X = OH, NH2, COO-) in solution
Peter I Nagy
International Journal of Molecular Sciences
|
May 19, 2015
Theoretical in-Solution Conformational/Tautomeric Analyses for Chain Systems with Conjugated Double Bonds Involving Nitrogen(s)
Peter I Nagy
The Journal of Physical Chemistry. B
|
June 21, 2011
Combined ab initio/DFT and Monte Carlo calculation of relative standard chemical potentials in solution
Peter I Nagy
Physical Chemistry Chemical Physics : PCCP
|
November 24, 2011
Structure simulations for the 0.22 and 1 molar aqueous dimethylammonium chloride solutions
Peter I Nagy
International Journal of Molecular Sciences
|
October 30, 2014
Competing intramolecular vs. intermolecular hydrogen bonds in solution
Peter I Nagy
International Journal of Molecular Sciences
|
July 14, 2016
Replacement of Oxygen by Sulfur in Small Organic Molecules. 3. Theoretical Studies on the Tautomeric Equilibria of the 2OH and 4OH-Substituted Oxazole and Thiazole and the 3OH and 4OH-Substituted Isoxazole and Isothiazole in the Isolated State and in Solution
Peter I Nagy
The Journal of Physical Chemistry. A
|
March 14, 2013
Are the intramolecular O-H···F and O-H···Cl hydrogen bonds maintained in solution? A theoretical study
Peter I Nagy
The Journal of Physical Chemistry. A
|
June 27, 2012
Theoretical studies of the solvent effect on the conformation of the HO-C-C-X (X = F, NH2, NO2) moiety with competing intra- and intermolecular hydrogen bonds
Peter I Nagy
Physical Chemistry Chemical Physics : PCCP
|
March 2, 2011
Molecular dynamics and Monte Carlo simulations for the structure of the aqueous trimethylammonium chloride solution in the 0.2-1 molar range
Susanna Monti, Peter I Nagy
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Search research articles
Search
Showing results (1-10 of 27) with videos related to
Sort By:
Page
of 3
Molecules (Basel, Switzerland)
|
July 26, 2013
In-solution conformational analysis of the XCYCH3 moiety for small esters and ethers with all combinations of X, Y = O, S
Peter I Nagy
Physical Chemistry Chemical Physics : PCCP
|
September 15, 2012
Theoretical study of the gauche-trans equilibrium with and without an intramolecular hydrogen bond for +H3NCH2CH2X systems (X = OH, NH2, COO-) in solution
Peter I Nagy
International Journal of Molecular Sciences
|
May 19, 2015
Theoretical in-Solution Conformational/Tautomeric Analyses for Chain Systems with Conjugated Double Bonds Involving Nitrogen(s)
Peter I Nagy
The Journal of Physical Chemistry. B
|
June 21, 2011
Combined ab initio/DFT and Monte Carlo calculation of relative standard chemical potentials in solution
Peter I Nagy
Physical Chemistry Chemical Physics : PCCP
|
November 24, 2011
Structure simulations for the 0.22 and 1 molar aqueous dimethylammonium chloride solutions
Peter I Nagy
International Journal of Molecular Sciences
|
October 30, 2014
Competing intramolecular vs. intermolecular hydrogen bonds in solution
Peter I Nagy
International Journal of Molecular Sciences
|
July 14, 2016
Replacement of Oxygen by Sulfur in Small Organic Molecules. 3. Theoretical Studies on the Tautomeric Equilibria of the 2OH and 4OH-Substituted Oxazole and Thiazole and the 3OH and 4OH-Substituted Isoxazole and Isothiazole in the Isolated State and in Solution
Peter I Nagy
The Journal of Physical Chemistry. A
|
March 14, 2013
Are the intramolecular O-H···F and O-H···Cl hydrogen bonds maintained in solution? A theoretical study
Peter I Nagy
The Journal of Physical Chemistry. A
|
June 27, 2012
Theoretical studies of the solvent effect on the conformation of the HO-C-C-X (X = F, NH2, NO2) moiety with competing intra- and intermolecular hydrogen bonds
Peter I Nagy
Physical Chemistry Chemical Physics : PCCP
|
March 2, 2011
Molecular dynamics and Monte Carlo simulations for the structure of the aqueous trimethylammonium chloride solution in the 0.2-1 molar range
Susanna Monti, Peter I Nagy
Page
of 3