• 3015 Citations
  • 26 h-Index
1968 …2019

Research output per year

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Article
2014

Conservative evolution, sustainability, and culture

Náray-Szabó, G., Mar 1 2014, In : CLCWeb - Comparative Literature and Culture. 16, 1, 10.

Research output: Contribution to journalArticle

5 Citations (Scopus)
2013

A self-compartmentalizing hexamer serine protease from Pyrococcus Horikoshii: Substrate selection achieved through multimerization

Menyhárd, D. K., Kiss-Szemán, A., Tichy-Rács, É., Hornung, B., Rádi, K., Szeltner, Z., Domokos, K., Szamosi, I., Náray-Szabó, G., Polgár, L. & Harmat, V., Jun 14 2013, In : Journal of Biological Chemistry. 288, 24, p. 17884-17894 11 p.

Research output: Contribution to journalArticle

11 Citations (Scopus)
2011

Structure and catalysis of acylaminoacyl peptidase: Closed and open subunits of a dimer oligopeptidase

Harmat, V., Domokos, K., Menyhárd, D. K., Palló, A., Szeltner, Z., Szamosi, I., Beke-Somfai, T., Náray-Szabó, G. & Polgár, L., Jan 21 2011, In : Journal of Biological Chemistry. 286, 3, p. 1987-1998 12 p.

Research output: Contribution to journalArticle

30 Citations (Scopus)
2009
9 Citations (Scopus)

Fenntartani a sokszínu′ világot. Jövo″ kép egy kis nemzet számára

Translated title of the contribution: To sustain a colourful world. Vision for a small nationNáray-Szabó, G., Dec 1 2009, In : Tarsadalomkutatas. 27, 4, p. 441-454 14 p.

Research output: Contribution to journalArticle

3 Citations (Scopus)

Four spatial points that define enzyme families

Iván, G., Szabadka, Z., Ördög, R., Grolmusz, V. & Náray-Szabó, G., Jun 12 2009, In : Biochemical and biophysical research communications. 383, 4, p. 417-420 4 p.

Research output: Contribution to journalArticle

7 Citations (Scopus)

Theoretical aspects of molecular recognition

Harmata, V. & Náray-Szabó, G., Jun 1 2009, In : Croatica Chemica Acta. 82, 1, p. 277-282 6 p.

Research output: Contribution to journalArticle

5 Citations (Scopus)
2008

Prolyl oligopeptidase inhibition by N-acyl-pro-pyrrolidine-type molecules

Kánai, K., Arányi, P., Böcskei, Z., Ferenczy, G., Harmat, V., Simon, K., Bátori, S., Náray-Szabó, G. & Hermecz, I., Dec 11 2008, In : Journal of Medicinal Chemistry. 51, 23, p. 7514-7522 9 p.

Research output: Contribution to journalArticle

17 Citations (Scopus)

Revisiting the mechanism of the autoactivation of the complement protease C1r in the C1 complex: Structure of the active catalytic region of C1r

Kardos, J., Harmat, V., Palló, A., Barabás, O., Szilágyi, K., Gráf, L., Náray-Szabó, G., Goto, Y., Závodszky, P. & Gál, P., Mar 1 2008, In : Molecular Immunology. 45, 6, p. 1752-1760 9 p.

Research output: Contribution to journalArticle

29 Citations (Scopus)

Structural and kinetic contributions of the oxyanion binding site to the catalytic activity of acylaminoacyl peptidase

Kiss, A. L., Palló, A., Náray-Szabó, G., Harmat, V. & Polgár, L., May 1 2008, In : Journal of Structural Biology. 162, 2, p. 312-323 12 p.

Research output: Contribution to journalArticle

12 Citations (Scopus)
2007

A combined electronegativity equalization and electrostatic potential fit method for the determination of atomic point charges

Berente, I., Czinki, E. & Náray-Szabó, G., Sep 1 2007, In : Journal of Computational Chemistry. 28, 12, p. 1936-1942 7 p.

Research output: Contribution to journalArticle

13 Citations (Scopus)
12 Citations (Scopus)
19 Citations (Scopus)
2006
25 Citations (Scopus)

Hungarian chemistry in the 21st century

Naray-Szabo, G., May 2006, In : Nachrichten aus der Chemie. 54, 5, p. 530-531 2 p.

Research output: Contribution to journalArticle

38 Citations (Scopus)
2005

A true autoactivating enzyme: Structural insight into mannose-binding lectin-associated serine protease-2 activations

Gál, P., Harmat, V., Kocsis, A., Bián, T., Barna, L., Ambrus, G., Végh, B., Balczer, J., Sim, R. B., Náray-Szabó, G. & Závodszky, P., Sep 30 2005, In : Journal of Biological Chemistry. 280, 39, p. 33435-33444 10 p.

Research output: Contribution to journalArticle

83 Citations (Scopus)

Energy decomposition scheme for combined Ab initio quantum mechanical / molecular mechanical methods

Berente, I. & Náray-Szabó, G., Aug 15 2005, In : International Journal of Quantum Chemistry. 104, 3, p. 328-334 7 p.

Research output: Contribution to journalArticle

Predicting anti-HIV-1 activities of HEPT-analog compounds by using support vector classification

Lu, W., Dong, N. & Náray-Szabó, G., Nov 1 2005, In : QSAR and Combinatorial Science. 24, 9, p. 1021-1025 5 p.

Research output: Contribution to journalArticle

15 Citations (Scopus)

The structure of the complex of calmodulin with KAR-2: A novel mode of binding explains the unique pharmacology of the drug

Horváth, I., Harmat, V., Perczel, A., Pálfi, V., Nyitray, L., Nagy, A., Hlavanda, E., Náray-Szabó, G. & Ovádi, J., Mar 4 2005, In : Journal of Biological Chemistry. 280, 9, p. 8266-8274 9 p.

Research output: Contribution to journalArticle

19 Citations (Scopus)
2004
43 Citations (Scopus)
65 Citations (Scopus)
2003

Computer modelling of enzyme reactions

Náray-Szabó, G. & Berente, I., Dec 29 2003, In : Journal of Molecular Structure: THEOCHEM. 666-667, p. 637-644 8 p.

Research output: Contribution to journalArticle

7 Citations (Scopus)
16 Citations (Scopus)
2002

A hypothetical mechanism for HIV-1 integrase catalytic action: DFT modelling of a bio-mimetric environment

Bernardi, F., Bottoni, A., De Vivo, M., Garavelli, M., Keserü, G. & Náray-Szabó, G., Aug 13 2002, In : Chemical Physics Letters. 362, 1-2, p. 1-7 7 p.

Research output: Contribution to journalArticle

24 Citations (Scopus)
29 Citations (Scopus)
2001

Quantitative estimation of electrostatic complementarity

Náray-Szabó, G., Dec 1 2001, In : Match. 44, p. 297-304 8 p.

Research output: Contribution to journalArticle

3 Citations (Scopus)
2000

A new potent calmodulin antagonist with arylalkylamine structure: Crystallographic, spectroscopic and functional studies

Harmat, V., Böcskei, Z., Náray-Szabó, G., Bata, I., Csutor, A. S., Hermecz, I., Arányi, P., Szabó, B., Liliom, K., Vértessy, B. G. & Ovádi, J., Mar 31 2000, In : Journal of molecular biology. 297, 3, p. 747-755 9 p.

Research output: Contribution to journalArticle

31 Citations (Scopus)
1 Citation (Scopus)

Chemical fragmentation in a quantum mechanical treatment of extended covalent systems

Naray-Szabo, G., Jan 1 2000, In : Zhurnal Fizicheskoi Khimii. 74, 1, p. 41-47 7 p.

Research output: Contribution to journalArticle

Construction of a 3D model of oligopeptidase B, a potential processing enzyme in prokaryotes

Gérczei, T., Keserü, G. M. & Náray-Szabó, G., Jan 1 2000, In : Journal of Molecular Graphics and Modelling. 18, 1, p. 7-17 11 p.

Research output: Contribution to journalArticle

25 Citations (Scopus)

Electrostatic effects on the catalytic cleavage of ammonia at the stepped Si(111)-2 x 1 surface

Kádas, K., Füsti Molnár, L. & Náray-Szabó, G., Apr 28 2000, In : Journal of Molecular Structure: THEOCHEM. 501-502, p. 459-464 6 p.

Research output: Contribution to journalArticle

1 Citation (Scopus)

Elektrosztatikus katalízis

Gábor, N. S., Jan 1 2000, In : Magyar Kemiai Folyoirat, Kemiai Kozlemenyek. 106, 8, p. 331-336 6 p.

Research output: Contribution to journalArticle

Enzyme mechanisms: Interplay of theory and experiment

Náray-Szabó, G., Apr 3 2000, In : Journal of Molecular Structure: THEOCHEM. 500, 1-3, p. 157-167 11 p.

Research output: Contribution to journalArticle

9 Citations (Scopus)

Mechanism of Action of D-Xylose Isomerase

Asbóth, B. & Náray-Szabó, G., Nov 2000, In : Current Protein and Peptide Science. 1, 3, p. 237-254 18 p.

Research output: Contribution to journalArticle

48 Citations (Scopus)
1999

Comparative redox and pK(a) calculations on cytochrome c3 from several Desulfovibrio species using continuum electrostatic methods

Martel, P. J., Soares, C. M., Baptista, A. M., Fuxreiter, M., Náray-Szabó, G., Louro, R. O. & Carrondo, M. A., Feb 1 1999, In : Journal of Biological Inorganic Chemistry. 4, 1, p. 73-86 14 p.

Research output: Contribution to journalArticle

35 Citations (Scopus)
24 Citations (Scopus)

Electrostatic effects in proteins

Náray-Szabó, G., Dec 1 1999, In : Periodicum Biologorum. 101, 4, p. 325-331 7 p.

Research output: Contribution to journalArticle

1 Citation (Scopus)
1 Citation (Scopus)

QSAR for cycloaliphatic alcohols with qualitatively defined sandalwood odour characteristics

Hadaruga, D. I., Muresan, S., Bologa, C., Chiriac, A., Simon, Z., Cofar, L. & Naray-Szabo, G., Jul 1999, In : Quantitative Structure-Activity Relationships. 18, 3, p. 253-261 9 p.

Research output: Contribution to journalArticle

10 Citations (Scopus)

Quantum catalysis: The modeling of catalytic transition states

Hall, M. B., Margl, P., Náray-Szabó, G., Schramm, V. L., Truhlar, D. G., Van Santen, R. A., Warshel, A. & Whitten, J. L., Dec 1 1999, In : ACS Symposium Series. 721, p. 2-17 16 p.

Research output: Contribution to journalArticle

9 Citations (Scopus)
11 Citations (Scopus)
13 Citations (Scopus)

The three-dimensional structure of Asp189Ser trypsin provides evidence for an inherent structural plasticity of the protease

Szabó, E., Böcskei, Z., Náray-Szabó, G. & Gráf, L., Jul 1 1999, In : European Journal of Biochemistry. 263, 1, p. 20-26 7 p.

Research output: Contribution to journalArticle

28 Citations (Scopus)
1998

3 Quantum mechanical treatment of enzyme reactions

Náray-Szabó, G. & Menyhárd, D. K., Dec 1 1998, In : Annual Reports on the Progress of Chemistry - Section C. 94, p. 49-88 40 p.

Research output: Contribution to journalArticle

Crystallization and preliminary X-ray analysis of porcine muscle prolyl oligopeptidase

Böcskei, Z., Fuxreiter, M., Náray-Szabó, G., Szabó, E. & Polgár, L., Dec 1 1998, In : Acta Crystallographica Section D: Biological Crystallography. 54, 6 PART II, p. 1414-1415 2 p.

Research output: Contribution to journalArticle

6 Citations (Scopus)

Electrostatics and reactivity of surface defects on Si(111)-(2 X 1)

Kádas, K. & Náray-Szabó, G., Dec 18 1998, In : Journal of Molecular Structure: THEOCHEM. 455, 2-3, p. 213-218 6 p.

Research output: Contribution to journalArticle

1 Citation (Scopus)
21 Citations (Scopus)
58 Citations (Scopus)
1997
5 Citations (Scopus)