☰

Milán Szőri - Publications

Affiliations: 
University of Miskolc 
Area:
computational chemistry
Tree Info Similar researchers PubMed Report error

37 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2023 Rózsa ZB, Hantal G, Szőri M, Fábián B, Jedlovszky P. Understanding the Molecular Mechanism of Anesthesia: Effect of General Anesthetics and Structurally Similar Non-Anesthetics on the Properties of Lipid Membranes. The Journal of Physical Chemistry. B. PMID 37368412 DOI: 10.1021/acs.jpcb.3c02976  0.737
2022 Thangaraj R, Fiser B, Qiu X, Li C, Viskolcz B, Szőri M. An Ab Initio Investigation on Relevant Oligomerization Reactions of Toluene Diisocyanate (TDI). Polymers. 14. PMID 36236129 DOI: 10.3390/polym14194183  0.677
2022 Olasz B, Fiser B, Szőri M, Viskolcz B, Owen MC. Computational Elucidation of the Solvent-Dependent Addition of 4-Hydroxy-2-nonenal (HNE) to Cysteine and Cysteinate Residues. The Journal of Organic Chemistry. PMID 36148484 DOI: 10.1021/acs.joc.2c01487  0.76
2022 Balbisi M, Horváth RA, Szőri M, Jedlovszky P. Computer simulation investigation of the adsorption of acetamide on low density amorphous ice. An astrochemical perspective. The Journal of Chemical Physics. 156: 184703. PMID 35568547 DOI: 10.1063/5.0093561  0.738
2022 Honti B, Szőri M, Jedlovszky P. Description of the Interfacial Behavior of Benzonitrile at Icy Surfaces by Grand Canonical Monte Carlo Simulations. The Journal of Physical Chemistry. A. 126: 1221-1232. PMID 35168326 DOI: 10.1021/acs.jpca.1c10749  0.735
2022 Nagy M, Fiser B, Szőri M, Vanyorek L, Viskolcz B. Optical Study of Solvatochromic Isocyanoaminoanthracene Dyes and 1,5-Diaminoanthracene. International Journal of Molecular Sciences. 23. PMID 35163239 DOI: 10.3390/ijms23031315  0.637
2021 Waleed HQ, Csécsi M, Hadjadj R, Thangaraj R, Pecsmány D, Owen M, Szőri M, Fejes Z, Viskolcz B, Fiser B. Computational Study of Catalytic Urethane Formation. Polymers. 14. PMID 35012031 DOI: 10.3390/polym14010008  0.725
2021 Rózsa ZB, Szőri-Dorogházi E, Viskolcz B, Szőri M. Transmembrane penetration mechanism of cyclic pollutants inspected by molecular dynamics and metadynamics: the case of morpholine, phenol, 1,4-dioxane and oxane. Physical Chemistry Chemical Physics : Pccp. 23: 15338-15351. PMID 34254082 DOI: 10.1039/d1cp01521d  0.793
2021 Prekob Á, Muránszky G, Szőri M, Karacs G, Kristály F, Ferenczi T, Fiser B, Viskolcz B, Vanyorek L. Preparation of highly effective carbon black supported Pd-Pt bimetallic catalysts for nitrobenzene hydrogenation. Nanotechnology. 32. PMID 34252897 DOI: 10.1088/1361-6528/ac137d  0.625
2021 Chiovini B, Pálfi D, Majoros M, Juhász G, Szalay G, Katona G, Szőri M, Frigyesi O, Lukácsné Haveland C, Szabó G, Erdélyi F, Máté Z, Szadai Z, Madarász M, Dékány M, et al. Theoretical Design, Synthesis, and In Vitro Neurobiological Applications of a Highly Efficient Two-Photon Caged GABA Validated on an Epileptic Case. Acs Omega. 6: 15029-15045. PMID 34151084 DOI: 10.1021/acsomega.1c01164  0.74
2019 Cheikh W, Rózsa ZB, Camacho López CO, Mizsey P, Viskolcz B, Szőri M, Fejes Z. Urethane Formation with an Excess of Isocyanate or Alcohol: Experimental and Ab Initio Study. Polymers. 11. PMID 31546721 DOI: 10.3390/polym11101543  0.77
2019 Rózsa ZB, Németh LJ, Jójárt B, Nehéz K, Viskolcz B, Szőri M. Molecular Dynamics and Metadynamics Insights of 1,4-Dioxane-Induced Structural Changes of Biomembrane Models. The Journal of Physical Chemistry. B. 123: 7869-7884. PMID 31452375 DOI: 10.1021/acs.jpcb.9b04313  0.763
2019 Hamid AKM, Salvatore JC, Wang K, Murahari P, Guljas A, Rágyanszki A, Owen M, Jójárt B, Szőri M, Csizmadia IG, Viskolcz B, Fiser B. Oxidatively-mediated in silico epimerization of a highly amyloidogenic segment in the human calcitonin hormone (hCT). Computational Biology and Chemistry. 80: 259-269. PMID 31048244 DOI: 10.1016/J.Compbiolchem.2019.04.005  0.73
2019 Kiss B, Picaud S, Szőri M, Jedlovszky P. Adsorption of Formamide at the Surface of Amorphous and Crystalline Ices under Interstellar and Tropospheric Conditions. A Grand Canonical Monte Carlo Simulation Study. The Journal of Physical Chemistry. A. 123: 2935-2948. PMID 30839213 DOI: 10.1021/acs.jpca.9b00850  0.767
2018 Horváth RA, Hantal G, Picaud S, Szőri M, Jedlovszky P. Adsorption of Methylamine on Amorphous Ice under Interstellar Conditions. A Grand Canonical Monte Carlo Simulation Study. The Journal of Physical Chemistry. A. 122: 3398-3412. PMID 29537265 DOI: 10.1021/acs.jpca.8b01591  0.719
2018 Pálfi D, Chiovini B, Szalay G, Kaszás A, Turi GF, Katona G, Ábrányi-Balogh P, Szőri M, Potor A, Frigyesi O, Lukácsné Haveland C, Szadai Z, Madarász M, Vasanits-Zsigrai A, Molnár-Perl I, et al. High efficiency two-photon uncaging coupled by the correction of spontaneous hydrolysis. Organic & Biomolecular Chemistry. PMID 29497727 DOI: 10.1039/C8Ob00025E  0.753
2017 Kiss B, Fábián B, Idrissi A, Szőri M, Jedlovszky P. Correction to "Miscibility and Thermodynamics of Mixing of Different Models of Formamide and Water in Computer Simulation". The Journal of Physical Chemistry. B. 121: 9319. PMID 28944670 DOI: 10.1021/acs.jpcb.7b09210  0.752
2017 Kiss B, Fábián B, Idrissi A, Szőri M, Jedlovszky P. Miscibility and Thermodynamics of Mixing of Different Models of Formamide and Water in Computer Simulation. The Journal of Physical Chemistry. B. 121: 7147-7155. PMID 28657740 DOI: 10.1021/acs.jpcb.7b04965  0.759
2017 Khaled F, Giri BR, Szőri M, Mai TV, Huynh LK, Farooq A. A combined high-temperature experimental and theoretical kinetic study of the reaction of dimethyl carbonate with OH radicals. Physical Chemistry Chemical Physics : Pccp. PMID 28230869 DOI: 10.1039/C6Cp07318B  0.362
2013 Bänsch C, Kiecherer J, Szöri M, Olzmann M. Reaction of dimethyl ether with hydroxyl radicals: kinetic isotope effect and prereactive complex formation. The Journal of Physical Chemistry. A. 117: 8343-51. PMID 23914942 DOI: 10.1021/jp405724a  0.772
2012 Owen MC, Szori M, Csizmadia IG, Viskolcz B. Conformation-dependent ˙OH/H2O2 hydrogen abstraction reaction cycles of Gly and Ala residues: a comparative theoretical study. The Journal of Physical Chemistry. B. 116: 1143-54. PMID 22168541 DOI: 10.1021/Jp2089559  0.705
2011 Fiser B, Szori M, Jójárt B, Izsák R, Csizmadia IG, Viskolcz B. Antioxidant potential of glutathione: a theoretical study. The Journal of Physical Chemistry. B. 115: 11269-77. PMID 21853966 DOI: 10.1021/Jp2049525  0.772
2011 Szori M, Jójárt B, Izsák R, Szori K, Csizmadia IG, Viskolcz B. Chemical evolution of biomolecule building blocks. Can thermodynamics explain the accumulation of glycine in the prebiotic ocean? Physical Chemistry Chemical Physics : Pccp. 13: 7449-58. PMID 21431107 DOI: 10.1039/C0Cp02687E  0.788
2011 Jójárt B, Szori M, Izsák R, Marsi I, László A, Csizmadia IG, Viskolcz B. The effect of a Pro²⁸Thr point mutation on the local structure and stability of human galactokinase enzyme-a theoretical study. Journal of Molecular Modeling. 17: 2639-49. PMID 21264483 DOI: 10.1007/S00894-011-0958-Y  0.767
2010 Szori M, Jedlovszky P, Roeselová M. Water adsorption on hydrophilic and hydrophobic self-assembled monolayers as proxies for atmospheric surfaces. A grand canonical Monte Carlo simulation study. Physical Chemistry Chemical Physics : Pccp. 12: 4604-16. PMID 20428540 DOI: 10.1039/b923382b  0.784
2009 Izsák R, Szőri M, Knowles PJ, Viskolcz B. High Accuracy ab Initio Calculations on Reactions of OH with 1-Alkenes. The Case of Propene. Journal of Chemical Theory and Computation. 5: 2313-21. PMID 26616616 DOI: 10.1021/Ct900133V  0.715
2009 Szori M, Csizmadia IG, Fittschen C, Viskolcz B. Theoretical study on reactions of HO2 radical with photodissociation products of Cl2SO (ClSO and SO). The Journal of Physical Chemistry. A. 113: 9981-7. PMID 19694477 DOI: 10.1021/Jp901183K  0.507
2009 Szöri M, Tobias DJ, Roeselová M. Microscopic wetting of mixed self-assembled monolayers: a molecular dynamics study. The Journal of Physical Chemistry. B. 113: 4161-9. PMID 19243138 DOI: 10.1021/Jp8074139  0.761
2009 Moussa SG, McIntire TM, Szori M, Roeselová M, Tobias DJ, Grimm RL, Hemminger JC, Finlayson-Pitts BJ. Experimental and theoretical characterization of adsorbed water on self-assembled monolayers: understanding the interaction of water with atmospherically relevant surfaces. The Journal of Physical Chemistry. A. 113: 2060-9. PMID 19173586 DOI: 10.1021/Jp808710N  0.77
2008 Szori M, Csizmadia IG, Viskolcz B. Nonenzymatic Pathway of PUFA Oxidation. A First-Principles Study of the Reactions of OH Radical with 1,4-Pentadiene and Arachidonic Acid. Journal of Chemical Theory and Computation. 4: 1472-9. PMID 26621433 DOI: 10.1021/ct800127a  0.389
2007 Mucsi Z, Tsai A, Szori M, Chass GA, Viskolcz B, Csizmadia IG. A quantitative scale for the extent of conjugation of the amide bond. Amidity percentage as a chemical driving force. The Journal of Physical Chemistry. A. 111: 13245-54. PMID 18041826 DOI: 10.1021/Jp0759325  0.778
2007 Sahai MA, Szöri M, Viskolcz B, Pai EF, Csizmadia IG. Transition state infrared spectra for the trans-->cis isomerization of a simple peptide model. The Journal of Physical Chemistry. A. 111: 8384-9. PMID 17685601 DOI: 10.1021/Jp074991F  0.707
2007 Szori M, Abou-Abdo T, Fittschen C, Csizmadia IG, Viskolcz B. Allylic hydrogen abstraction II. H-abstraction from 1,4 type polyalkenes as a model for free radical trapping by polyunsaturated fatty acids (PUFAs). Physical Chemistry Chemical Physics : Pccp. 9: 1931-40. PMID 17431521 DOI: 10.1039/B613048H  0.446
2007 Bentz T, Giri BR, Hippler H, Olzmann M, Striebel F, Szöri M. Reaction of hydrogen atoms with propyne at high temperatures: an experimental and theoretical study. The Journal of Physical Chemistry. A. 111: 3812-8. PMID 17388398 DOI: 10.1021/Jp070833C  0.783
2006 Szori M, Fittschen C, Csizmadia IG, Viskolcz B. Allylic H-Abstraction Mechanism:  The Potential Energy Surface of the Reaction of Propene with OH Radical. Journal of Chemical Theory and Computation. 2: 1575-86. PMID 26627028 DOI: 10.1021/Ct600140B  0.457
2006 Law JM, Szori M, Izsak R, Penke B, Csizmadia IG, Viskolcz B. Folded and unfolded conformations of the omega-3 polyunsaturated fatty acid family: ch(3)ch(2)[ch=chch(2)](b)[ch(2)](m)cooh: first principles study. The Journal of Physical Chemistry. A. 110: 6100-11. PMID 16671681 DOI: 10.1021/Jp058215O  0.713
2005 Tasi G, Szöri M, Csaszar AG. Semispectroscopic and quantitative structure-property relationship estimates of the equilibrium and vibrationally averaged structure and dipole moment of 1-buten-3-yne. The Journal of Physical Chemistry. A. 109: 4824-8. PMID 16833826 DOI: 10.1021/jp058005b  0.764
Show low-probability matches.