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Docosahexaenoic acid (DHA) as a free radical scavenger brain protector
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Here you can view and search the projects funded by NKFI since 2004
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B. Viskolcz and S. J. K. Jensen: Theoretical studies of carbon dioxide catalysis of peroxynitrite isomerizations'', J. Mol. Struc. (THEOCHEM) 57-60 731, (2005)., 2005 | 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, 520-533, 109, 2005, 2005 | A. Bottoni, I. L. Hegedűs, M. A. Sahai, M. Szori, G. Paragi, B. Viskolcz: Side-chain Conformational Potential Energy Surface of N-acetyl-selenocisteine-N-methylamide (MeCO-L-Sec-NHMe) in its L backbone conformation, J. Mol. Struc. (THEOCHEM) (2005) 726, 55/59, 2005 | 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, 2005 | J.M.S. Law, Sz. Fejer, D.H. Setiadi, G.A. Chass, B. Viskolcz:: Molecular Orbital Computations on Lipids, J. Mol. Struc. (THEOCHEM) (2005) 722, 79-96, 2005 | 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, 107, (2005), 2005 | C. Nagy, Sz. Fejer, Livia Berek, Joseph Molnar, B. Viskolcz: Hydrogen bondings in deoxynivalenol (DON) conformations A density functional study, J. Mol. Struc. (THEOCHEM) 55-59, 726, (2005)., 2005 | 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, (2006) in press see ASAPsap paper, 2006 | 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. 2006 in press., 2006 | 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, (2006) in press., 2006 | 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 2006 in press, 2006 | Z. Mucsi, A. Szabó, I. Hermecz, Á. Kucsman, I. G. Csizmadia.: Modelling Rate-Controlling Solvent Effects. The Pericyclic Meisenheimer Rearrangement of N-propargylmorpholine N-oxide., J. Am.Chem. Soc. 127; 7615-7631, 2005 | T-H. Tang, E. Deretey, S. J. Knak Jensen, I. G. Csizmadia: Hydrogen bonds: Relation between lengths and electron densities at bond critical points., Eur. Phys. J. D. 37;217-222, 2006 | A. Láng, I. G. Csizmadia and A. Perczel: Peptide Models XLV. Conformational Properties of N-Formyl-L-Methioninamide and its Relevance to Methionine in Proteins., Proteins 58; 571 – 588, 2005 | Tamás Beke, Imre G. Csizmadia and András Perczel.: Parallel -sheet assemblies of -peptides form nanotubes. Tertiary structure elements of -peptides, J. Am Chem. Soc. 2006 (accepted), 2006 |
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