Items where Author is "Oláh, Julianna"

Article

Szabó, Zsolt Péter and Benza, Málna and Nikoletti, Edina and Oláh, Julianna and Miasnikov, Gréti Mirtyll (2022) „Nem tudom mi kárpótolhatná a magyar nemzet lelkét a 20. századért” – a magyar nemzeti csoporthoz kapcsolódó kollektív áldozati vélekedések vizsgálata. Magyar Pszichológiai Szemle. ISSN 0025-0279

Szabó, Zsolt Péter and Benza, Málna and Nikoletti, Edina and Oláh, Julianna and Miasnikov, Gréti Mirtyll (2022) „Nem tudom mi kárpótolhatná a magyar nemzet lelkét a 20. századért” – a magyar nemzeti csoporthoz kapcsolódó kollektív áldozati vélekedések vizsgálata. MAGYAR PSZICHOLÓGIAI SZEMLE, 77 (4). pp. 461-481. ISSN 0025-0279

Kiss, Dóra Judit and Oláh, Julianna and Tóth, Gergely and Varga, Máté and Stirling, András and K. Menyhárd, Dóra and Ferenczy, György G. (2022) The Structure-Derived Mechanism of Box H/ACA Pseudouridine Synthase Offers a Plausible Paradigm for Programmable RNA Editing. ACS CATALYSIS, 12. pp. 2756-2769. ISSN 2155-5435

Meelua, Wijitra and Keawkla, Natchayatorn and Oláh, Julianna and Jitonnom, Jitrayut (2020) DFT study of formation and properties of dinuclear zirconocene cations: Effects of ligand structure, solvent, and metal on the dimerization process. JOURNAL OF ORGANOMETALLIC CHEMISTRY, 905. ISSN 0022-328X

Lábas, Anikó and Menyhárd, K Dóra and Harvey, Jeremy N and Oláh, Julianna (2018) First principles calculation of the reaction rates for ligand binding to myoglobin: the cases of NO and CO. CHEMISTRY-A EUROPEAN JOURNAL, 24 (20). pp. 5350-5358. ISSN 0947-6539

Benedek, Zsolt and Papp, Marcell and Oláh, Julianna and Szilvási, Tibor (2018) Identifying the Rate-Limiting Elementary Steps of Nitrogen Fixation with Single-Site Fe Model Complexes. INORGANIC CHEMISTRY, 57. pp. 8499-8508. ISSN 0020-1669

Kiss, Dóra J. and Oláh, Julianna and Tóth, Gergely and Menyhárd, Dóra K. and Ferenczy, György G. (2018) Quantum chemical calculations support pseudouridine synthase reaction through a glycal intermediate and provide details of the mechanism. THEORETICAL CHEMISTRY ACCOUNTS. ISSN 1432-881X (In Press)

Xue, Shufang and Guo, Yunnan and Rotaru, Aurelian and Müller-Bunz, Helge and Morgan, Grace G. and Trzop, Elzbieta and Collet, Eric and Oláh, Julianna and Garcia, Yann (2018) Spin Crossover Behavior in a Homologous Series of Iron(II) Complexes Based on Functionalized Bipyridyl Ligands. INORGANIC CHEMISTRY, 57 (16). pp. 9880-9891. ISSN 0020-1669

Lábas, Anikó and Krámos, Balázs and Oláh, Julianna (2017) Combined Docking and Quantum Chemical Study on CYP-mediated Metabolism of Estrogens in Man. CHEMICAL RESEARCH IN TOXICOLOGY, 30 (2). pp. 583-594. ISSN 0893-228X

Bakó, Imre and Lábas, Anikó and Hermansson, Kersti and Bencsura, Ákos and Oláh, Julianna (2017) How can we detect hydrogen bond local cooperativity in liquid water: a simulation study. JOURNAL OF MOLECULAR LIQUIDS, 245. pp. 140-146. ISSN 0167-7322

Lábas, Anikó and Bakó, Imre and Oláh, Julianna (2017) Hydration sphere structure of proteins: a theoretical study. JOURNAL OF MOLECULAR LIQUIDS, 238. pp. 462-469. ISSN 0167-7322

Bakó, Imre and Oláh, Julianna and Lábas, Anikó and Bálint, Szabolcs and Pusztai, László (2017) Water-Formamide Mixtures: Topology of the Hydrogen-Bonded Network. JOURNAL OF MOLECULAR LIQUIDS, 228. pp. 25-31. ISSN 0167-7322

Gráczer, Éva Laura and Szimler, Tamás and Garamszegi, Anita and Konarev, Petr V. and Lábas, Anikó and Oláh, Julianna and Palló, Anna and Závodszky, Péter and Kazinczyné Vas, Mária (2016) Dual Role of the Active Site Residues of Thermus thermophilus 3-Isopropylmalate Dehydrogenase: Chemical Catalysis and Domain Closure. BIOCHEMISTRY, 55 (3). pp. 560-574. ISSN 0006-2960

Szabó, Tamás and Dargó, Gergő and Szentjóbi, Hajnalka and Tóth, Tünde and Krámos, Balázs and Oláh, Julianna and Németh, Tamás and Balogh, György Tibor and Huszthy, Péter (2016) Synthesis, experimental and theoretical studies on the factors influencing the pKa values of new crown ethers containing a diarylphosphinic acid unit. TETRAHEDRON, 72 (52). pp. 8593-8602. ISSN 0040-4020

Lábas, Anikó and Krámos, Balázs and Bakó, Imre and Oláh, Julianna (2015) Accurate modeling of cation–π interactions in enzymes: a case study on the CDPCho:phosphocholine cytidylyltransferase complex. STRUCTURAL CHEMISTRY. pp. 1-13. ISSN 1040-0400

Gráczer, Éva Laura and Palló, Anna and Oláh, Julianna and Szimler, Tamás and Konarev, Petr V. and Závodszky, Péter and Kazinczyné Vas, Mária (2015) Glutamate 270 plays an essential role in K+-activation and domain closure of Thermus thermophilus isopropylmalate dehydrogenase. FEBS LETTERS, 589 (2). pp. 240-245. ISSN 0014-5793

Oláh, Julianna and van Bergen, Laura and De Proft, Frank and Roos, Goedele (2015) How does the protein environment optimize the thermodynamics of thiol sulfenylation? Insights from model systems to QM/MM calculations on human 2-Cys peroxiredoxin. JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 33 (3). pp. 584-596. ISSN 0739-1102

Marton, Lívia and Nagy, Gergely N. and Ozohanics, Olivér and Lábas, Anikó and Krámos, Balázs and Oláh, Julianna and Vékey, Károly and Vértessy, Beáta G. (2015) Molecular Mechanism for the Thermo-Sensitive Phenotype of CHO-MT58 Cell Line Harbouring a Mutant CTP : Phosphocholine Cytidylyltransferase. PLOS ONE, 10 (6). e0129632. ISSN 1932-6203

Vanpoucke, Danny E. P. and Oláh, Julianna and De Proft, Frank and Van Speybroeck, Veronique and Roos, Goedele (2015) On the Convergence of Atomic Charges with the Size of the Enzymatic Environment. JOURNAL OF CHEMICAL INFORMATION AND MODELING, 55 (3). pp. 564-571. ISSN 1549-9596

Krámos, Balázs and Oláh, Julianna (2015) The mechanism of human aromatase (CYP 19A1) revisited: DFT and QM/MM calculations support a compound I-mediated pathway for the aromatization process. STRUCTURAL CHEMISTRY, 26 (1). pp. 279-300. ISSN 1040-0400

Szoboszlai, Norbert and Guo, Xinghua and Ozohanics, Olivér and Oláh, Julianna and Gömöry, Ágnes and Mihucz, Victor G. and Jeney, András and Vékey, Károly (2014) Determination of energy metabolites in cancer cells by porous graphitic carbon liquid chromatography – electrospray ionization mass spectrometry for the assessment of energy metabolism. Analytica Chimica Acta, 819. pp. 108-115. ISSN 0003-2670

Palló, Anna and Oláh, Julianna and Gráczer, Éva Laura and Merli, Angelo and Závodszky, Péter and Kazinczyné Vas, Mária (2014) Structural and energetic basis of isopropylmalate dehydrogenase enzyme catalysis. FEBS JOURNAL, 281 (22). pp. 5063-5076. ISSN 1742-464X

Nagy N., Gergely and Marton, Lívia and Krámos, Balázs and Oláh, Julianna and Révész, Ágnes and Vékey, Károly and Delsuc, Frederic and Hunyadi-Gulyás, Éva and Medzihradszky, Katalin F. and Lavigne, Marina and Vial, Henri and Cerdan, Rachel and Vértessy G., Beáta (2013) Evolutionary and mechanistic insights into substrate and product accommodation of CTP:phosphocholine cytidylyltransferase from Plasmodium falciparum. FEBS Journal. ISSN 1742-464X

Bakó, Imre and Bencsura, Ákos and Hermannson, Kersti and Bálint, Szabolcs and Grósz, Tamás and Oláh, Julianna (2013) Hydrogen bond network topology in liquid water and methanol: a graph theory approach. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 15 (36). pp. 15163-15171. ISSN 1463-9076

Monograph

Veszprémi, Tamás and Bajor, Gábor and Nyakas, Péter and Oláh, Julianna and Olasz, András Miklós and Pintér, Balázs (2009) Rövid élettartamú elemorganikus vegyületek elméleti és spektroszkópiai vizsgálata = Theoretical and Spectroscopical Study of Short lived Organometallic Compounds. Project Report. OTKA.