1.             B. Viskolcz, G. Lendvay, T. Körtvélyesi and L. Seres: "Intramolecular H Atom Trans­fer Reactions in Alkyl radicals and the Ring Strain Energy in the Transition Structure"
J. Am. Chem. Soc. 3006, 118 (1996).

2.             B. Viskolcz, "Transition States and Branching Ratios in selected Unimolecular reac­tions." Dissertacion, Halle, (1996).

3.             K. Hoyermann, J. Seeba, M. Olzmann, and B. Viskolcz: "The Gas Phase Reactions of Benzyl Radicals with O, O₃ and NO₃: Rate, Mechanism and Unimolecular Decomposi­tion of the Chemically Activated Benzoxy Radical".
Ber. Bunsenges. Phys. Chem., 538, 101, (1997).

4.             B. Viskolcz, G. Lendvay and L. Seres: "Ab initio Barrier Heights and Branching ratios of Isomerization Reactions of a Branched Alkyl Radical."
J. Phys. Chem. A., 7119, 101, (1997).

5.             H. Ziemer, S. Dóbé, H. Gg. Wagner, M. Olzmann, B. Viskolcz, and F. Temps: "Kinetics of the Reactions of HCO with H and D Atoms." Ber. Bunsenges. Phys. Chem., 897, 102, (1998).

6.             G. Lendvay, B. Viskolcz, "Ab Initio Studies of the Isomerization and Decomposition Reactions of the 1-butoxy Radical". J. Phys. Chem. A. 10777, 102, (1998).

7.             P. Devolder, Ch. Fittschen, A. Frenzel, H. Hippler, G. Poskrebyshev, F. Striebel, and B. Viskolcz:"Complete falloff curves for the unimolecular decomposition of i-propoxy-radicals between 330 and 408 K." Phys. Chem. Chem. Phys. 675, 1, (1999).

8.             K. Hoyermann, J. Seeba, M. Olzmann, and B. Viskolcz: "The Reactions of C₂H₅ Radi­cals with O, O₃, NO₃ and NO₂: Decomposition Pathways of the Intermediarily Formed C₂H₅O Radical." J. Phys. Chem. A, 5692, 103, (1999).

9.             F. Caralp, P. Devolder, C. Fittschen, N. Gomez, H. Hippler, R. Méreau, M. T. Rayez, F. Striebel, and B. Viskolcz, "The thermal unimolecular decomposition rate constants of ethoxy radicals." Phys. Chem. Chem. Phys. 2935, 1, (1999).

10.         I. Marsi, B. Viskolcz, L. Seres, "Application of the Group Additivity Method to Alkyl Radicals; an ab Initio Study." J. Phys. Chem. A, 4497, 104, (2000).

11.         Ch. Fittschen, H. Hippler, and B. Viskolcz: "The β C-C bond scission in alkoxy radicals: thermal unimolecular decomposition of t-butoxy radicals."
Phys .Chem. Chem. Phys. . 1677, 2, (2000).

12.         H. Hippler, and B. Viskolcz: "Addition complex formation versus direct abstraction in the OH + C2H4 reaction." Phys. Chem. Chem. Phys. 3591, 2, (2000).

13.         B. Viskolcz, T. Bérces, " Enthalpy of formation of selected carbonyl radicals from theory and comparison with experiment" Phys. Chem. Chem. Phys. 5340, 2, (2000).

14.         W. Hack, K. Hoyermann, C. Kersten, M. Olzmann and B. Viskolcz: "Competing reaction pathways of highly excited n-C₄H₉O radicals formed in the n‑C₄H₉ + O reaction" Phys. Chem. Chem. Phys. 2365, 3, (2001).

15.         H. Hippler, F. Striebel and B. Viskolcz: "A detailed experimental and theoretical study on the decomposition of methoxy radicals" Phys. Chem. Chem. Phys. 2450, 3, (2001).

16.         H. Hippler, and B. Viskolcz: “Competition between Alkyl Radical Addition to Carbonyl Bonds and H-Atom Abstraction Reactions” Phys. Chem. Chem. Phys. 4663, 4, (2002).

17.         T.A.K. Kehoe, M.R. Peterson, G.A. Chass, B. Viskolcz, L. Stacho, and I.G. Csizmadia: “The Fitting and Functional Analysis of a Double Rotor Potential Energy Surface for the R and S enantiomers of 1-chloro-3-floro-isobutane” J. Mol. Struc. (THEOCHEM) 79-87, 666-667C, (2003).

18.         S.J. Salpietro, B. Viskolcz, I.G. Csizmadia: “An exploratory ab initio study on the entropy of various backbone conformers for the HCO-Gly-Gly-Gly-NH₂ tripeptide motif” J. Mol. Struc. (THEOCHEM) 89-94, 666-667C, (2003).

19.         M. Szori and B. Viskolcz “Conformation Analysis of 1,4-Pentadien-3-yl Radicals by Ab Initio and DFT Methods” J. Mol. Struc. (THEOCHEM) 153-158, 666-667C, (2003).

20.         V.V. Kónya, P.G. Meszaros B. Viskolcz, I.G. Csizmadia “Conformational analysis of oxidized vitamin-C” J. Mol. Struc. (THEOCHEM) 397-400, 666-667C, (2003).

21.         J.M.S. Law, J.C.P. Koo, D.H. Setiadi,G.A. Chass, B. Viskolcz and I.G. Csizmadia “Molecular Orbital Computations on Lipids: Modular Numbering “ J. Mol. Struc. (THEOCHEM) 445-449, 666, (2003).

22.         D.M. Gasparro, D.R.P. Almeida, L.F. Pisterzi, J.R. Juhasz, B.Viskolcz, B.Penke and I.G. Csizmadia “Reaction Profiling of the MAO-B Catalyzed Oxidative Deamination of Amines in Alzheimer’s Disease” J. Mol. Struc. (THEOCHEM), 527-536, 666-667C,  (2003).

23.         W. Hack, K. Hoyermann, M. Olzmann, B. Viskolcz, J. Wehmeyer and T. Zeuch "Formation and Decomposition of Chemically Activated neo-C₅H₁₁O Radicals. An Experimental and Theoretical Study" Proceedings of the European Combustion Meeting „ECM2003” (2003).

24.         I. Szilágyi, S. Dóbé, T. Bérces, F. Márta and B. Viskolcz "Direct Kinetic Study of Reactions of Hydroxyl Radicals with Alkyl Formates." Z. Phys. Chem. 479-492, 218 (2004).

25.         W. Hack, K. Hoyermann, M. Olzmann, B. Viskolcz, J. Wehmeyer and T. Zeuch "Formation and Decomposition of Chemically Activated i-C₄H₉O and neo-C₅H₁₁O Radicals. An Experimental and Theoretical Study." Proceedings of the Combustion Institute 1005-1013, 30 (2005).

26.         J. M.S. Law, D.H. Setiadi, G.A. Chass, I.G. Csizmadia and B. Viskolcz "Flexibility of Polyunsaturated Fatty Acid Chains and Peptide Backbones: A Comparative ab initio Study J. Phys. Chem. A, 530, 107, (2005).

27.         M.A. Sahai, T.A. K. Kehoe, J.C.P. Koo, D.H. Setiadi, G.A. Chass, B. Viskolcz,B. Penke, E.F. Pai and I.G. Csizmadia, First Principle Computational Study on the Full Conformational Space of L-Proline Diamides J. Phys. Chem. A,  2660, 107, (2005)

28.         J.M.S. Law, Sz. Fejer, D.H. Setiadi, G.A. Chass, B. Viskolcz: Molecular Orbital Computations on Lipids J. Mol. Struc. (THEOCHEM) 79-96, 722 (2005).

29.         R. S. Mirasol, D.H. Setiadi, T.H. Tang, W. Chin, M. Mons, I. Dimicoli, J. Dognon, B. Viskolcz, S. Lovas, Botond Penke, G. A. Chass and I. G. Csizmadia "Determination of Conformational Characteristics of N-Acetyl-Phenylalanyl-NH₂ by RHF, DFT, MP2 Computation and Bader-AIM Analyses,Confirmed by Jet-Cooled Infrared Spectroscopic Data." J. Phys. Chem. A,  5289, 109, (2005)

30.         I. L. Hegedűs, M. A. Sahai, M. Szori, G. Paragi, B. Viskolcz A. Bottoni: "Side-chain Conformational Potential Energy Surface of N-acetyl-selenocisteine-N-methylamide (MeCO-L-Sec-NHMe) in its b_L backbone conformation." J. Mol. Struc. (THEOCHEM) 111-125, 725, (2005).

31.         C. Nagy, Sz. N. Fejer, L. Berek, J. Molnar, B. Viskolcz: "Hydrogen bondings in deoxynivalenol (DON) conformations. A density functional study." J. Mol. Struc. (THEOCHEM) 55-59, 726, (2005).

32.         B. Viskolcz and S. J. K. Jensen: "Theoretical studies of carbon dioxide catalysis of peroxynitrite isomerizations" J. Mol. Struc. (THEOCHEM) 57-60 731, (2005).

33.         E. Delbos, Ch. Fittschen, H. Hippler, N. Kravesta, M. Olzmann, B. Viskolcz "Rate Constants and Equilibrium Constant for the Reaction of Vinoxy Radicals with Oxygen" J. Phys.Chem.A. 3238, 110, (2006).

34.         B. Viskolcz, Sz. N. Fejer, Milan Szori, and Imre G. Csizmadia "Thermodynamic functions of conformational folding I. A comparative first principle study on 1,2-disubstituted ethanes." Mol. Phys. 795–803, 104, (2006).

35.         B. Viskolcz, Sz. N. Fejer and I.G. Csizmadia "Thermodynamic Functions of Conformational Changes. 2. Conformational Entropy as a Measure of Information Accumulation." J. Phys. Chem.A.3808, 110, (2006).

36.         J.M.S. Law, M. Szőri, R. Izsak, B. Penke, I.G. Csizmadia B. Viskolcz, "Folded and Unfolded Conformations of ω-3 Polyunsaturated Fatty Acid Family: CH₃–CH₂-[CH=CH–CH₂–]_N–[CH₂]_M-COOH. First Principle Study." J. Phys. Chem. A, 6100, 110 2006.

37.         M. Hassouna, E. Delbos, P. Devolder, B. Viskolcz, Ch. Fittschen, "Rate and equilibrium constant of the reaction of 1-Methylvinoxy radicals with O₂: CH₃COCH₂ + O₂ « CH₃COCH₂O₂." J. Phys. Chem. A, 6667, 110, 2006.

38.         M.A. Sahai, Sz.N. Fejer, B. Viskolcz, E.F. Pai, I.G. Csizmadia, „A First-Principle Computational Study on the Full Conformational Space of L-Threonine Diamide: Energetic Stability of cis and trans” J. Phys. Chem. A., 11527, 110, 2006.

39.         R. Izsak, B. Jojart, I.G. Csizmadia B. Viskolcz, " The Role of Aromacity, Ring strain and Stereochemistry of Selected Disulphides and their congeners in the oxidative linkage of DNA strands at the Major Grove. A Computational Study " J. Chem. Inf. Mod., 2527-2536, 46, 2006.

40.         M. Szőri C. Fittschen, I. G. Csizmadia and B. Viskolcz Allylic H-abstraction Mechanism The potential energy surface for the reaction of propene with OH radical J. Chem. Comp. Theory, 1575, 2, 2006.

41.         Sz. N. Fejer I.G. Csizmadia and B. Viskolcz," Conformational Network of Glycine Diamide Folding, Entropy Lowering and Informational Accumulation." J. Phys. Chem. A, 13325-13331, 110, 2006.

42.         M. Szőri, C. Fittschen, I. G. Csizmadia and B. Viskolcz Allylic H-abstraction III. Allylic Hydrogen Abstraction from 1,4 Type Polyalkenes Phys. Chem.Chem. Phys. 1931-1940, 9, 2007. IF = 3.343

43.         Zoltán Mucsi, Béla Viskolcz, Imre G. Csizmadia, A Quantitaive Scale for the Degree of Aromaticity and Anti-aromaticity, J. Phys. Chem. A 1123-1132, 111, 2007. IF= 2,918

44.         Z. Mucsi, T. Kötvélyesi, B. Viskolcz, I. G. Csizmadia, G. Keglevich, “Can four-membered heterophosphete structures exist? The contribution of phosphorus d orbitals to antiaromaticity” Eur. J. Org. Chem. 1759-1767, 2007. IF= 2.914

45.         B. Viskolcz, M. Szori, R. Izsak, Sz. N. Fejer, and I. G. Csizmadia "Thermodynamic Functions of Conformational Changes." Functional Analysis of Conformational Entropy of substituated ethane and methanol Int. J. Quantum Chem. 1826-1834, 107, 2007. IF= 1,368

46.         M. A. Sahai, M. Szori, B. Viskolcz, E. F. Pai and I. G. Csizmadia, “Transition State Infrared Spectra for the Trans→Cis Isomerization of a Simple Peptide Model” J. Phys. Chem. A, 8384 -8389, 111, 2007. IF= 2,918

47.         M. A. Sahai, B. Viskolcz, E. F. Pai and I. G. Csizmadia, “Quantifying the Intrinsic Effects of Two Point Mutation Models of Pro-Pro diamino acid diamide. A First-Principle Computational Study” J. Phys. Chem. B, 11592-11602, 111, 2007. IF= 4,086

48.         M. A. Sahai, B. Viskolcz, E. F. Pai and I. G. Csizmadia, “Quantifying the Intrinsic Effects of Two Point Mutation Models of Pro-Pro-Pro triamino acid diamide. A First-Principle Computational Study” J. Phys. Chem. B, 13135-13142, 111, 2007. IF= 4,086

49.         Z. Mucsi, A. Tsai, M. Szori, G. A. Chass, B. Viskolcz, I. G. Csizmadia, A quantitative scale for the extent of conjugation of the amide bond. Amidity percentage as a chemical driving force J. Phys. Chem. A, 13245 -13254, 111, 2007. IF= 2,918

50.         B. Balogh, B. Jójart, Zs. Wágner, P. Kovacs, K. Gyires, Z. Zadori, Gy. Falkay, A. Marki, B. Viskolcz, P. Matyus, “3D QSAR models for alpha(2a)-adrenoceptor agonists” Neurochemistry International 268-276, 51, 2007. IF= 2,975

51.         B. Viskolcz, Sz. N. Fejer, A. Perczel, S. J. K. Jensen and I.G. Csizmadia " Maximal Information Accumulation in Polypeptide Secondary Structures “ Chem. Phys. Letter, 123-126, 450, 2007. IF= 2,207

52.         Z. Mucsi, I. Hermecz, B. Viskolcz, I. G. Csizmadia, G. Keglevich, “Can four member heterophosphete structures exist? The Influence of Exocyclic Phosphorous Substituents on Intrinsic Stability” Tetrahedron 1868-1878 64 (2008). IF= 2,869

53.         M. F. Andrada, J. C. G. Martínez, M. Szori, G. N. Zamarbide, F. T. Vert, B. Viskolcz, Mario R. Estrada  and I. G. Csizmadia, “Thermodynamics of competing oxidation reactions of allyl-methyl disulfide by hydrogen peroxide. A first principle molecular computacional study on the conformations of allyl-methyl disulfide and its oxidized products” J. Phys. Org. Chem. 2008, 21, 1-11. IF= 1.593

54.         Jojart, Balazs, Kiss, Robert, Viskolcz, Bela, Keseru, György M. “Theoretical Investigation of the Activation Mechanism of the Human Histamine H4 Receptor – An Explicit Membrane Molecular Dynamics Simulation Study" J. Chem. Inf. Model, , 47, 2008. 48, 1199-1210. IF= 2.986

55.         M. Szőri, I. G. Csizmadia and B. Viskolcz " Non-enzymatic pathway of PUFA oxidation A first principles study on the reactions of OH radical with 1,4 pentadiene and arachidonic acid" J. Chem. Theory Comput. 2008, 4, 1472–1479. IF= 4,308

56.         Mucsi, Zoltán; Chass, Gregory; Viskolcz, Bela; Csizmadia, Imre: "A quantitative scale for the extent of conjugation of carbonyl groups. "Carbonylicity" percentage as a chemical driving force" J. Phys. Chem. A 2008, 112, 9153–9165 IF= 2,918

57.         DongJin R. Lee, Nathalie J. Galant; Hui, Wang; Zoltán, Mucsi; Setiadi, David; Viskolcz, Bela; Csizmadia, Imre; Thermodynamic Functions of Molecular Conformations of N-protonated-β-fluoro-β-phenylethylamine and N-protonated-β-hydroxy-β-phenylethylamine, as Models for Protonated Noradrenaline and Adrenaline First-Principle Computational Study of Conformations and Thermodynamic Functions for the Noradrenaline and Adrenaline Models
J. Phys. Chem. A 2009 113, 2507–2515.

58.         Balázs Jójárt, Béla Viskolcz, Imre G. Csizmadia, Aranka László, Éva Sallay, Emoke Endreffy, Tamás Constantin, György Fekete, Markus Ries. D266Y - a new alpha galactosidase A gene mutation detected in a Hungarian family with Fabry disease - Experimental and theoretical investigation Phil. Nat. 2009, 1, 33-42.

59.         Hui Wang, Zoltan Mucsi, Imre G. Csizmadia, Gregory A. Chass, De C. Fang and Bela Viskolcz: A Prelude to Design Biofriendly Nanostructural Arms using Biological Hinges as Models. First Principle Conformational Analysis on the Ala → Phe Point Mutation in Proline Environment Phil. Nat. 2009, 1, 77-98.

60.         B. Viskolcz, L. Seres, Ab initio study on alkyl radical decomposition and alkyl radical addition to olefins. React. Kinet. Catal. Lett. 2009, 96, 245−262. IF= 0,61

61.         Mucsi, Zoltán; Chass, Gregory; Viskolcz, Bela; Csizmadia, Imre A quantitative scale for the extent of conjugation of substituted olefines. Olefinicity percentage as a chemical driving force J. Phys. Chem. A 2009, 114, 7953-7962. IF= 2,918

62.         Hui Wang, Imre G. Csizmadia, István Marsi, Gregory A. Chass, De C. Fang and Bela Viskolcz: Ala → Phe Point Mutation in Proline Environment Hydrogen bonds in Pro-Ala-Pro and Pro-Phe-Pro. J. Chem. Phys. 2009, 131, 035105.  IF= 3,149

63.         Natalie J. Galant, Hui Wang, DongJin R. Lee, Zoltan Mucsi, David H. Setiadi, Bela Viskolcz and Imre G. Csizmadia, The Thermodynamic Role of Glutathione Oxidation by Peroxide and Peroxybicarbonate in the Prevention of Alzheimer’s Disease and Cancer J. Phys. Chem. A, 2009, 114, 9138–9149 IF= 2,918

64.         Róbert Izsák, Milán Szőri, Peter J. Knowles, and Béla Viskolcz, High Accuracy Ab Initio Calculations on Reactions of OH with 1-Alkenes. The Case of Propene, J. Chem. Theory Comput., 2009, 5 (9), pp 2313–2321 IF= 4,308

65.         M. Szőri C. Fittschen, I. G. Csizmadia and B. Viskolcz, Theoretical Study on Reaction of HO₂ Radical with Photodissociation Products of Cl₂SO (ClSO and SO) J. Phys. Chem. A 2009, , 113, 9981 - 9987 IF= 2,918