Search Results - "Biela, Monika"

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  1. 1

    Antioxidant action of deprotonated flavonoids: Thermodynamics of sequential proton-loss electron-transfer by Biela, Monika, Rimarčík, Ján, Senajová, Erika, Kleinová, Andrea, Klein, Erik

    Published in Phytochemistry (Oxford) (01-12-2020)
    “…Despite the intensive research on radical scavenging action of flavonoids, a systematic study of the thermochemistry for their mono-deprotonated species in…”
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    Journal Article
  2. 2

    Thermodynamics of demethylation of polymethoxyflavones: Implications for antioxidant and photoprotective activity by Kleinová, Andrea, Biela, Monika, Lukeš, Vladimír, Klein, Erik

    Published in Journal of molecular structure (05-05-2024)
    “…•Thermodynamics of methoxy groups demethylation for polymethoxyflavones is studied.•O–CH3 bond dissociation enthalpies of methoxy groups lie in 70 kJ mol–1…”
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    Journal Article
  3. 3

    Phenolic acids and their carboxylate anions: Thermodynamics of primary antioxidant action by Biela, Monika, Kleinová, Andrea, Klein, Erik

    Published in Phytochemistry (Oxford) (01-08-2022)
    “…Phenolic acids represent naturally occurring antioxidants and play important role in free radicals scavenging. In this work, we have studied thermodynamics of…”
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    Journal Article
  4. 4

    Guaiacol oxidation: theoretical insight into thermochemistry of radical processes involving methoxy group demethylation by Biela, Monika, Kleinová, Andrea, Klein, Erik

    Published in Free radical research (02-12-2022)
    “…Guaiacol (2-methoxyphenol) is naturally occurring phenolic compound essential in various research areas. Oxidative transformation of guaiacol can lead to the…”
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    Journal Article
  5. 5

    Thermodynamics of radical scavenging effect of deprotonated isoflavones in aqueous solution by Biela, Monika, Kleinová, Andrea, Klein, Erik

    Published in Journal of molecular liquids (01-01-2022)
    “…[Display omitted] •Antioxidant action of isoflavone anions is studied in aqueous solution.•Reaction enthalpies of sequential proton-loss electron-transfer are…”
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    Journal Article
  6. 6

    Investigation of substituent effect on O–C bond dissociation enthalpy of methoxy group in meta- and para-substituted anisoles by Biela, Monika, Kleinová, Andrea, Uhliar, Matej, Klein, Erik

    Published in Journal of molecular graphics & modelling (01-07-2023)
    “…This paper is focused on the theoretical investigation of O–C Bond Dissociation Enthalpy (BDE) of methoxy OCH3 group in 15 meta- and 15 para-substituted…”
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    Journal Article
  7. 7

    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)
    “…[Display omitted] •Aromaticity changes upon metal ions chelation are analyzed.•Binding energies for selected metal complexes are investigated.•Vertical…”
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  8. 8

    Cu(II) complexes of flavonoids in solution: Impact of the Cu(II) ion on the antioxidant and DNA-intercalating properties by Šimunková, Miriama, Biela, Monika, Štekláč, Marek, Hlinčík, Andrej, Klein, Erik, Malček, Michal

    Published in Journal of molecular liquids (01-08-2022)
    “…[Display omitted] •Complexes of Cu(II) with flavonoids are studied in two solvents: DMSO and methanol.•Formation of complexes is monitored by UV-Vis…”
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    Journal Article
  9. 9