Search Results - "Michalik, Martin" :: K.UTB vyhledávací portál

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From phenols to quinones: Thermodynamics of radical scavenging activity of para-substituted phenols

by Michalík, Martin, Poliak, Peter, Lukeš, Vladimír, Klein, Erik
Published in Phytochemistry (Oxford) (01.10.2019)

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Methoxylated flavones with potential therapeutic and photo-protective attributes: Theoretical investigation of substitution effect

by Štellerová, Dagmar, Michalík, Martin, Lukeš, Vladimír
Published in Phytochemistry (Oxford) (01.11.2022)

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On energetics of proton and electron transfer of selected phenol derivatives: Theoretical investigation of radical and oxonium cations

by Kováčová, Andrea, Michalík, Martin, Lukeš, Vladimír
Published in International journal of quantum chemistry (15.12.2023)

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Chelates of 3- and 5-hydroxyflavone: Quantum chemical study

by Michalík, Martin, Biela, Monika, Cagardová, Denisa, Lukeš, Vladimír
Published in Chemical physics letters (01.01.2021)

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On the toxicity of para-substituted phenols and their quinone metabolites: Quantum chemical study

by Michalík, Martin, Poliak, Peter, Klein, Erik, Lukeš, Vladimír
Published in Chemical physics letters (01.10.2018)

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The radical scavenging ability of phenylenediamine species: The role of electron and proton transfer processes in their oxidative transformation

by Kováčová, Andrea, Michalík, Martin, Hartmann, Horst, Lukeš, Vladimír
Published in Journal of molecular liquids (01.11.2023)

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Protective role of quercetin against copper(II)-induced oxidative stress: A spectroscopic, theoretical and DNA damage study

by Jomova, Klaudia, Lawson, Michael, Drostinova, Lenka, Lauro, Peter, Poprac, Patrik, Brezova, Vlasta, Michalik, Martin, Lukes, Vladimir, Valko, Marian
Published in Food and chemical toxicology (01.12.2017)

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Density-functional theoretical study of fluorination effect on the electronic structure and electron drift mobilities of symmetric pentacene derivatives

by Lukeš, Vladimír, Cagardová, Denisa, Michalík, Martin, Poliak, Peter
Published in Synthetic metals (01.06.2018)

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Theoretical comparative study of promising semiconducting aromatic molecules and their fluorinated counterparts

by Cagardová, Denisa, Matúška, Ján, Michalík, Martin, Poliak, Peter, Lukeš, Vladimír
Published in Synthetic metals (01.02.2020)

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Electronic structure and charge-transport properties of symmetric linear condensed bis-benzothiadiazole derivatives

by Cagardová, Denisa, Michalík, Martin, Poliak, Peter, Lukeš, Vladimír
Published in Journal of molecular structure (05.01.2019)

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Spectroscopic behavior of alloxazine-based dyes with extended aromaticity: Theory vs Experiment

by Cagardová, Denisa, Truksa, Jan, Michalík, Martin, Richtár, Jan, Weiter, Martin, Krajčovič, Jozef, Lukeš, Vladimír
Published in Optical materials (01.07.2021)

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The computational analysis and modelling of substitution effects on hydrolysis of formanilides in acidic aqueous solutions

by Lukeš, Vladimír, Škorňa, Peter, Michalík, Martin, Klein, Erik
Published in Chemical physics letters (01.11.2017)

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B3LYP Study of 3-hydroxynaphthalene-2-carboxanilide para-derivatives

by Michalík, Martin, Poliak, Peter, Lukeš, Vladimír
Published in Acta chimica Slovenica (01.03.2018)

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Theoretical insight on model linear oligomers and their ring-fused analogs used in organic electronics

by Cagardová, Denisa Mastiľák, Matúška, Jan, Michalík, Martin, Lukeš, Vladimír
Published in Materials today communications (01.12.2022)

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Antioxidant action of phenols: Revisiting theoretical calculations of their thermodynamics

by Biela, Monika, Pelikánová, Bernadeta, Michalík, Martin
Published in Acta Chimica Slovaca (01.10.2019)

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The structural analysis and modelling of ring substituent effect for the ortho-derivatives of 1-hydroxynaphthalene-2-carboxanilides and 2-hydroxynaphthalene-1-carboxanilides

by Škorňa, Peter, Michalík, Martin, Lukeš, Vladimír, Klein, Erik
Published in Journal of molecular structure (15.09.2017)

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The validation of quantum chemical lipophilicity prediction of alcohols

by Michalík, Martin, Lukeš, Vladimír
Published in Acta Chimica Slovaca (01.10.2016)

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Gallic acid: thermodynamics of the homolytic and heterolytic phenolic O—H bonds splitting-off

by Škorňa, Peter, Michalík, Martin, Klein, Erik
Published in Acta Chimica Slovaca (01.10.2016)

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Theoretical study of lumichrome, 1-methyl-lumichrome and lumiflavin binding ability with thymine

by Cagardová, Denisa, Michalík, Martin, Lukeš, Vladimír
Published in Acta Chimica Slovaca (01.01.2021)

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Influence of catecholic ring torsion on hydroxyflavones

by Michalík, Martin, Biela, Monika, Cagardová, Denisa, Lukeš, Vladimír
Published in Acta Chimica Slovaca (01.04.2020)

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