Items where Author is "Rokob, Tibor András"

Article

Révész, Ágnes and Rokob, Tibor András and Jeanne Dit Fouque, Dany and Hüse, Dániel and Háda, Viktor and Turiák, Lilla and Memboeuf, Antony and Vékey, Károly and Drahos, László (2019) Optimal collision energies and bioinformatics tools for efficient bottom-up sequence validation of monoclonal antibodies. ANALYTICAL CHEMISTRY. ISSN 0003-2700 (In Press)

Rokob, Tibor András (2016) Pathways for Arene Oxidation in Non-Heme Diiron Enzymes: Lessons from Computational Studies on Benzoyl-Coenzyme A Epoxidase. Journal of the American Chemical Society, 138 (44). pp. 14623-14638. ISSN 0002-7863 (print), 1520-5126 (online)

Rokob, Tibor András (2016) Mono- and Binuclear Non-Heme Iron Chemistry from a Theoretical Perspective. JOURNAL OF BIOLOGICAL INORGANIC CHEMISTRY, 21 (5). pp. 619-644. ISSN 0949-8257

Palkó, Roberta and Lejtoviczné Egyed, Orsolya and Rokob, Tibor András and Bombicz, Petra and Riedl, Zsuzsanna and Hajós, György (2015) Transformation of Zwitterionic Pyridine Derivatives to a Spiro-Fused Ring System: Azoniabenzo[de]fluorine. Synthesis and Mechanistic Rationalization. JOURNAL OF ORGANIC CHEMISTRY, 80 (1). pp. 174-179. ISSN 0022-3263

Palkó, Roberta and Egyed, Orsolya and Rokob, Tibor András and Bombicz, Petra and Riedl, Zsuzsanna and Hajós, György (2015) Transformation of zwitterionic pyridine derivatives to a spiro fused ring system: azoniabenzo[de]fluorine. Synthesis and mechanistic rationalization. The Journal of Organic Chemistry, 80 (1). pp. 174-179. ISSN 0022-3263

Chalupsky, Jakub and Rokob, Tibor András and Kurashige, Yuki and Yanai, Takeshi and Soomon, Edward I. (2014) Reactivity of the Binuclear Non-Heme Iron Active Site of Delta(9) Desaturase Studied by Large-Scale Multireference Ab Initio Calculations. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 136 (45). pp. 15977-15991. ISSN 0002-7863

Tsybizova, Alexandra and Rulíšek, Lubomír and Schröder, Detlef and Rokob, Tibor András (2013) Coordination and Bond Activation in Complexes of Regioisomeric Phenylpyridines with the Nickel(II) Chloride Cation in the Gas Phase. Journal of Physical Chemistry A, 117. pp. 1171-1180. ISSN 1089-5639

Révész, Ágnes and Rokob, Tibor András and Maász, Gábor and Márk, László and Hevér, Helga and Drahos, László and Vékey, Károly (2013) Fragmentation, structure, and energetics of small sodium formate clusters : evidence for strong influence of entropic effects. INTERNATIONAL JOURNAL OF MASS SPECTROMETRY, 354. pp. 292-302. ISSN 1387-3806

Rokob, Tibor András and Pápai, Imre (2013) Hydrogen Activation by Frustrated Lewis Pairs: Insights from Computational Studies. Topics in Current Chemistry, 332. pp. 157-212. ISSN 0340-1022

Rokob, Tibor András and Bakó, Imre and Stirling, András and Hamza, Andrea and Pápai, Imre (2013) Reactivity Models of Hydrogen Activation by Frustrated Lewis Pairs: Synergistic Electron Transfers or Polarization by Electric Field? Journal of the American Chemical Society, 135 (11). pp. 4425-4437. ISSN 0002-7863 (print), 1520-5126 (online)

Monograph

Hajós, György and Gömöry, Ágnes and Horváth, Dániel Vajk and Jakus, Judit and Jemnitz, Katalin and Lejtoviczné Egyed, Orsolya and Lois, Isabella and Mehdi, Hasan and Palkó, Roberta and Pápai, Imre and Riedl, Zsuzsanna and Rokob, Tibor András and Soós, Tibor and Szigeti, Marianna and Takács, Daniella and Váradi, Linda (2013) Új szintézismódszerek kidolgozása és alkalmazása célzott hatásterületen aktív heterociklusos molekulák szintézisére = Elaboration and application of new synthetic methodologies for the synthesis of heterocyclic molecules of aimed biological activity. Project Report. OTKA.

Pápai, Imre and Hamza, Andrea and Kovács, Gábor and Rokob, Tibor András and Schubert, Gábor (2011) Homogén katalitikus reakciók kvantumkémiai tanulmányozása = Quantum Chemical Studies of Homogeneous Catalytic Reactions. Project Report. OTKA.