• 1590 Citations
  • 23 h-Index
19962020

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Article

3D QSAR models for α2a-adrenoceptor agonists

Balogh, B., Jójárt, B., Wágner, Z., Kovács, P., Máté, G., Gyires, K., Zádori, Z., Falkay, G., Márki, Á., Viskolcz, B. & Mátyus, P., Oct 1 2007, In : Neurochemistry international. 51, 5, p. 268-276 9 p.

Research output: Contribution to journalArticle

6 Citations (Scopus)

Ab initio barrier heights and branching ratios of isomerization reactions of a branched alkyl radical

Viskolcz, B., Lendvay, G. & Seres, L., Sep 18 1997, In : Journal of Physical Chemistry A. 101, 38, p. 7119-7127 9 p.

Research output: Contribution to journalArticle

49 Citations (Scopus)

Ab initio studies of the isomerization and decomposition reactions of the 1-butoxy radical

Lendvay, G. & Viskolcz, B., Dec 24 1998, In : Journal of Physical Chemistry A. 102, 52, p. 10777-10786 10 p.

Research output: Contribution to journalArticle

45 Citations (Scopus)

Ab initio study on alkyl radical decomposition and alkyl radical addition to olefins

Viskolcz, B. & Seres, L., Apr 1 2009, In : Reaction Kinetics and Catalysis Letters. 96, 2, p. 245-262 18 p.

Research output: Contribution to journalArticle

5 Citations (Scopus)

Absorption spectrum and absolute absorption cross sections of CH 3O2 radicals and CH3I molecules in the wavelength range 7473-7497 cm-1

Faragó, E. P., Viskolcz, B., Schoemaecker, C. & Fittschen, C., Dec 5 2013, In : Journal of Physical Chemistry A. 117, 48, p. 12802-12811 10 p.

Research output: Contribution to journalArticle

19 Citations (Scopus)

A computational study of glutathione and its fragments: N-acetylcisteinylglycine and γ-glutamylmethylamide

Ding, V. Z. Y., Dawson, S. S. H., Lau, L. W. Y., Lee, D. R., Galant, N. J., Setiadi, D. H., Jójárt, B., Szöri, M., Mucsi, Z., Viskolcz, B., Knak Jensen, S. J. & Csizmadia, I. G., Apr 29 2011, In : Chemical Physics Letters. 507, 1-3, p. 168-173 6 p.

Research output: Contribution to journalArticle

9 Citations (Scopus)

Activation mechanism of the human histamine H4 receptor - An explicit membrane molecular dynamics simulation study

Jójárt, B., Kiss, R., Viskolcz, B. & Keseru, G. M., Jun 1 2008, In : Journal of Chemical Information and Modeling. 48, 6, p. 1199-1210 12 p.

Research output: Contribution to journalArticle

36 Citations (Scopus)

Addition complex formation vs. Direct abstraction in the OH + C2H4 reaction

Hippler, H. & Viskolcz, B., Aug 15 2000, In : Physical Chemistry Chemical Physics. 2, 16, p. 3591-3596 6 p.

Research output: Contribution to journalArticle

45 Citations (Scopus)

A detailed experimental and theoretical study on the decomposition of methoxy radicals

Hippler, H., Striebel, F. & Viskolcz, B., Aug 11 2001, In : Physical Chemistry Chemical Physics. 3, 12, p. 2450-2458 9 p.

Research output: Contribution to journalArticle

54 Citations (Scopus)

A hidden active site in the potential drug target mycobacterium tuberculosis dUTPase is accessible through small amplitude protein conformational changes

Lopata, A., Leveles, I., Bendes, Á. Á., Viskolcz, B., Vértessy, B. G., Jójárt, B. & Tóth, J., Dec 16 2016, In : Journal of Biological Chemistry. 291, 51, p. 26320-26331 12 p.

Research output: Contribution to journalArticle

4 Citations (Scopus)

A high temperature kinetic study for the thermal unimolecular decomposition of diethyl carbonate

AlAbbad, M., Giri, B. R., Szőri, M., Viskolcz, B. & Farooq, A., Jan 1 2017, In : Chemical Physics Letters. 684, p. 390-396 7 p.

Research output: Contribution to journalArticle

3 Citations (Scopus)

Allylic H-abstraction mechanism: The potential energy surface of the reaction of propene with OH radical

Szori, M., Fittschen, C., Csizmadia, I. G. & Viskolcz, B., Dec 1 2006, In : Journal of chemical theory and computation. 2, 6, p. 1575-1586 12 p.

Research output: Contribution to journalArticle

58 Citations (Scopus)

Allylic hydrogen abstraction II. H-abstraction from 1,4 type polyalkenes as a model for free radical trapping by polyunsaturated fatty acids (PUFAs)

Szori, M., Abou-Abdo, T., Fittschen, C., Csizmadia, I. G. & Viskolcz, B., Apr 19 2007, In : Physical Chemistry Chemical Physics. 9, 16, p. 1931-1940 10 p.

Research output: Contribution to journalArticle

12 Citations (Scopus)

An ab initio investigation of the 4,40-methlylene diphenyl diamine (4,40-MDA) formation from the reaction of aniline with formaldehyde

Boros, R. Z., Farkas, L., Nehéz, K., Viskolcz, B. & Szori, M., Mar 1 2019, In : Polymers. 11, 3, 398.

Research output: Contribution to journalArticle

Open Access
4 Citations (Scopus)

An experimental and theoretical study on the kinetic isotope effect of C2H6 and C2D6 reaction with OH

Khaled, F., Giri, B. R., Szori, M., Viskolcz, B. & Farooq, A., Oct 30 2015, In : Chemical Physics Letters. 641, p. 158-162 5 p.

Research output: Contribution to journalArticle

4 Citations (Scopus)
7 Citations (Scopus)

An improved two-rotor function for conformational potential energy surfaces of 20 amino acid diamides

Villar, J. J. S., Valdez, A. R. L., Setiadi, D. H., Csizmadia, I. G., Viskolcz, B. & Rágyanszki, A., 2018, In : Canadian Journal of Chemistry. 96, 1, p. 58-71 14 p.

Research output: Contribution to journalArticle

1 Citation (Scopus)

Antioxidant potential of glutathione: A theoretical study

Fiser, B., Szóri, M., Jójárt, B., Izsák, R., Csizmadia, I. G. & Viskolcz, B., Sep 29 2011, In : Journal of Physical Chemistry B. 115, 38, p. 11269-11277 9 p.

Research output: Contribution to journalArticle

27 Citations (Scopus)

Application of carbonized ion exchange resin beads as catalyst support for gas phase hydrogenation processes

Prekob, Á., Hajdu, V., Muránszky, G., Kocserha, I., Fiser, B., Viskolcz, B. & Vanyorek, L., Feb 1 2020, In : Reaction Kinetics, Mechanisms and Catalysis. 129, 1, p. 85-94 10 p.

Research output: Contribution to journalArticle

1 Citation (Scopus)

Application of carbon nanotube coated aluminosilicate beads as “support on support” catalyst for hydrogenation of nitrobenzene

Vanyorek, L., Prekob, Á., Sikora, E., Reizer, E., Muránszky, G., Kristály, F., Viskolcz, B. & Fiser, B., Nov 25 2019, In : Journal of Industrial and Engineering Chemistry. 79, p. 307-313 7 p.

Research output: Contribution to journalArticle

1 Citation (Scopus)

Application of nitrogen doped bamboo-like carbon nanotube for development of electrically conductive lubricants

Vanyorek, L., Kiss, D., Prekob, Á., Fiser, B., Potyka, A., Németh, G., Kuzsela, L., Drees, D., Trohák, A. & Viskolcz, B., May 1 2019, In : Journal of Materials Research and Technology. 8, 3, p. 3244-3250 7 p.

Research output: Contribution to journalArticle

Open Access

Application of the Group Additivity Method to Alkyl Radicals: An ab Initio Study

Marsi, I., Viskolcz, B. & Seres, L., Jan 1 2000, In : Journal of Physical Chemistry A. 104, 19, p. 4497-4504 8 p.

Research output: Contribution to journalArticle

35 Citations (Scopus)

A prelude to building mathematical models for polypeptide folding: Analysis on the conformational potential energy hypersurface cross-sections of N -acetyl-glycyl-glycine- N ′-methylamide

Villar, J. J. S., Negm, L., Rágyanszki, A., Setiadi, D. H., Valdez, A. R. L., Viskolcz, B. & Csizmadia, I., Jan 1 2018, In : Canadian Journal of Chemistry. 96, 10, p. 912-921 10 p.

Research output: Contribution to journalArticle

37 Citations (Scopus)

A quantitative scale for the extent of conjugation of substituted olefines

Mucsi, Z., Chass, G. A., Viskolcz, B. & Csizmadia, I. G., Jul 9 2009, In : Journal of Physical Chemistry A. 113, 27, p. 7953-7962 10 p.

Research output: Contribution to journalArticle

10 Citations (Scopus)

A quantitative scale for the extent of conjugation of the amide bond, amidity percentage as a chemical driving force

Mucsi, Z., Tsai, A., Szori, M., Chass, G. A., Viskolcz, B. & Csizmadia, I. G., Dec 20 2007, In : Journal of Physical Chemistry A. 111, 50, p. 13245-13254 10 p.

Research output: Contribution to journalArticle

40 Citations (Scopus)

A theoretical study of the stability of disulfide bridges in various β-sheet structures of protein segment models

Galant, N. J., Song, H. C., Jákli, I., Viskolcz, B., Csizmadia, I. G., Knak Jensen, S. J. & Perczel, A., Feb 11 2014, In : Chemical Physics Letters. 593, p. 48-54 7 p.

Research output: Contribution to journalArticle

4 Citations (Scopus)

A theoretical study on the phosgenation of methylene diphenyl diamine (MDA)

Boros, R. Z., Koós, T., Wafaa, C., Nehéz, K., Farkas, L., Viskolcz, B. & Szőri, M., Aug 16 2018, In : Chemical Physics Letters. 706, p. 568-576 9 p.

Research output: Contribution to journalArticle

2 Citations (Scopus)

Atropisomerism of the Asn α radicals revealed by ramachandran surface topology

Gerlei, K. Z., Jákli, I., Szori, M., Jensen, S. J. K., Viskolcz, B., Csizmadia, I. G. & Perczel, A., Oct 17 2013, In : Journal of Physical Chemistry B. 117, 41, p. 12402-12409 8 p.

Research output: Contribution to journalArticle

6 Citations (Scopus)

Beyond chelation: EDTA tightly binds taq DNA polymerase, MutT and dUTPase and directly inhibits dNTPase activity

Lopata, A., Jójárt, B., Surányi, É. V., Takács, E., Bezúr, L., Leveles, I., Bendes, Á., Viskolcz, B., Vértessy, B. G. & Tóth, J., Oct 2019, In : Biomolecules. 9, 10, 621.

Research output: Contribution to journalArticle

Open Access

Big data reduction by fitting mathematical functions: A search for appropriate functions to fit Ramachandran surfaces

Rágyanszki, A., Gerlei, K. Z., Surányi, A., Kelemen, A., Knak Jensen, S. J., Csizmadia, I. G. & Viskolcz, B., Apr 1 2015, In : Chemical Physics Letters. 625, p. 91-97 7 p., 32824.

Research output: Contribution to journalArticle

3 Citations (Scopus)

Can four-membered heterophosphete structures exist? The contribution of phosphorus d orbitals to antiaromaticity

Mucsi, Z., Kötvélyesi, T., Viskolcz, B., Csizmadia, I. G., Novák, T. & Keglevich, G., Jun 22 2007, In : European Journal of Organic Chemistry. 11, p. 1759-1767 9 p.

Research output: Contribution to journalArticle

20 Citations (Scopus)

Carbon-dioxide management network in Hungary

Deák, C., Palotás, Á. B., Mizsey, P. & Viskolcz, B., Jan 1 2018, In : Chemical Engineering Transactions. 70, p. 2143-2148 6 p.

Research output: Contribution to journalArticle

Catalytic activity of maghemite supported palladium catalyst in nitrobenzene hydrogenation

Hajdu, V., Prekob, Á., Muránszky, G., Kocserha, I., Kónya, Z., Fiser, B., Viskolcz, B. & Vanyorek, L., Feb 1 2020, In : Reaction Kinetics, Mechanisms and Catalysis. 129, 1, p. 107-116 10 p.

Research output: Contribution to journalArticle

Open Access
1 Citation (Scopus)

Characterization of the conformational probability of N-acetyl- Phenylalanyl-NH 2 by RHF, DFT, and MP2 computation and AIM analyses, confirmed by jet-cooled infrared data

Chass, G. A., Mirasol, R. S., Setiadi, D. H., Tang, T. H., Chin, W., Mons, M., Dimicoli, I., Dognon, J. P., Viskolcz, B., Lovas, S., Penke, B. & Csizmadia, I. G., Jun 23 2005, In : Journal of Physical Chemistry A. 109, 24, p. 5289-5302 14 p.

Research output: Contribution to journalArticle

29 Citations (Scopus)

Chemical evolution of biomolecule building blocks. Can thermodynamics explain the accumulation of glycine in the prebiotic ocean?

Szori, M., Jójárt, B., Izsák, R., Szori, K., Csizmadia, I. G. & Viskolcz, B., Apr 28 2011, In : Physical Chemistry Chemical Physics. 13, 16, p. 7449-7458 10 p.

Research output: Contribution to journalArticle

11 Citations (Scopus)

Chlorate Elimination by Catalytically Hydrogenation, Catalyst Development and Characterization

Vanyorek, L., Bánhidi, O., Muránszky, G., Sikora, E., Prekob, Á., Boros, Z., Farkas, L. & Viskolcz, B., Jan 15 2019, In : Catalysis Letters. 149, 1, p. 196-202 7 p.

Research output: Contribution to journalArticle

Competition between alkyl radical addition to carbonyl bonds and H-atom abstraction reactions

Hippler, H. & Viskolcz, B., Oct 30 2002, In : Physical Chemistry Chemical Physics. 4, 19, p. 4663-4668 6 p.

Research output: Contribution to journalArticle

28 Citations (Scopus)

Complete falloff curves for the unimolecular decomposition of i-propoxy radicals between 330 and 408 K

Devolder, P., Fittschen, C., Frenzel, A., Hippler, H., Poskrebyshev, G., Striebel, F. & Viskolcz, B., Feb 15 1999, In : Physical Chemistry Chemical Physics. 1, 4, p. 675-681 7 p.

Research output: Contribution to journalArticle

57 Citations (Scopus)

Conformational analysis of oxidized vitamin-C

Kónya, V. V., Meszaros, P. G., Viskolcz, B. & Csizmadia, I. G., Dec 29 2003, In : Journal of Molecular Structure: THEOCHEM. 666-667, p. 397-400 4 p.

Research output: Contribution to journalArticle

6 Citations (Scopus)

Conformational and thermodynamic analysis of the COXIB scaffold using quantum chemical calculations

Owen, M. C., Szöri, M., Jojárt, B., Viskolcz, B. & Csizmadia, I. G., Feb 5 2012, In : International Journal of Quantum Chemistry. 112, 3, p. 922-936 15 p.

Research output: Contribution to journalArticle

Conformation analysis of 1,4-pentadien-3-yl radicals by ab initio and DFT methods

Szori, M. & Viskolcz, B., Dec 29 2003, In : Journal of Molecular Structure: THEOCHEM. 666-667, p. 153-158 6 p.

Research output: Contribution to journalArticle

1 Citation (Scopus)

Conformation change of opiorphin derivates. A theoretical study of the radical initiated epimerization of opiorphin

Szórád, J. J., Faragó, E. P., Rágyanszki, A., Cimino, F. A., Fiser, B., Owen, M. C., Jójárt, B., Morgado, C. A., Szori, M., Jensen, S. J. K., Csizmadia, I. G. & Viskolcz, B., Jul 17 2015, In : Chemical Physics Letters. 626, p. 29-38 10 p.

Research output: Contribution to journalArticle

1 Citation (Scopus)

Conformation-dependent oH/H2O2 hydrogen abstraction reaction cycles of Gly and Ala residues: A comparative theoretical study

Owen, M. C., Szóri, M., Csizmadia, I. G. & Viskolcz, B., Jan 26 2012, In : Journal of Physical Chemistry B. 116, 3, p. 1143-1154 12 p.

Research output: Contribution to journalArticle

28 Citations (Scopus)

Controlled antioxidative steps of the cell. the concept of chalcogenicity

Fiser, B., Mucsi, Z., Viskolcz, B., Knak Jensen, S. J. & Csizmadia, I. G., Dec 18 2013, In : Chemical Physics Letters. 590, p. 83-86 4 p.

Research output: Contribution to journalArticle

1 Citation (Scopus)

Critical evaluation of the potential energy surface of the CH3 + HO2reaction system

Faragó, E. P., Szori, M., Owen, M. C., Fittschen, C. & Viskolcz, B., Feb 7 2015, In : Journal of Chemical Physics. 142, 5, 054308.

Research output: Contribution to journalArticle

8 Citations (Scopus)

Development and Application of Carbon-Layer-Stabilized, Nitrogen-Doped, Bamboo-Like Carbon Nanotube Catalysts in CO2 Hydrogenation

Sikora, E., Prekob, Á., Halasi, G., Vanyorek, L., Pekker, P., Kristály, F., Varga, T., Kiss, J., Kónya, Z. & Viskolcz, B., Oct 2018, In : ChemistryOpen. 7, 10, p. 789-796 8 p.

Research output: Contribution to journalArticle

1 Citation (Scopus)

Development of N-doped bamboo-shaped carbon nanotube/magnesium oxide nanocomposites

Vanyorek, L., Prekob, Á., Sikora, E., Muránszky, G., El Mrabate, B., Udayakumar, M., Pekker, P., Viskolcz, B. & Németh, Z., Jan 1 2019, (Accepted/In press) In : Journal of Composite Materials.

Research output: Contribution to journalArticle

Development of nitrogen-doped bamboo-like carbon nanotubes coated zeolite beads as “support on support” catalyst for the catalytic hydrogenation of olefins

Vanyorek, L., Prekob, Á., Baráth, M., Németh, Z., Fiser, B. & Viskolcz, B., Aug 15 2019, In : Reaction Kinetics, Mechanisms and Catalysis. 127, 2, p. 705-714 10 p.

Research output: Contribution to journalArticle

Open Access
2 Citations (Scopus)

Dimension reduction in conformational analysis: A two-rotor mathematical model of amino acid diamide conformational potential energy surface

Villar, J. J. S., Valdez, A. R. L., Setiadi, D. H., Fiser, B., Viskolcz, B., Csizmadia, I. & Rágyanszki, A., Jan 1 2017, In : Canadian Journal of Chemistry. 95, 8, p. 830-836 7 p.

Research output: Contribution to journalArticle

2 Citations (Scopus)