Search Results - Vr ek, Valerije

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  1. 1
    A quantum chemical study of HOCl-induced transformations of carbamazepineElectronic supplementary information (ESI) available: Coordinates for all the calculated structures and corresponding energies. See DOI: 10.1039/c6ob02166b

    A quantum chemical study of HOCl-induced transformations of carbamazepineElectronic supplementary information (ESI) available: Coordinates for all the calculated structures and cor... by Tandari, Tana, Vr ek, Valerije, Šaki, Davor

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  2. 2
    Racemization of oxazepam and chiral 1,4-benzodiazepines. DFT study of the reaction mechanism in aqueous solution

    Racemization of oxazepam and chiral 1,4-benzodiazepines. DFT study of the reaction mechanism in aqueous solution by Hok, Lucija, Bo i evi, Lucija, Sremec, Helena, Šaki, Davor, Vr ek, Valerije

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  3. 3
    Estrogenic activity of plastic nanoparticle mixtures under settings

    Estrogenic activity of plastic nanoparticle mixtures under settings by Bo i evi, Lucija, Altmann, Korinna, Hildebrandt, Jana, Knigge, Xenia, Vr ek, Valerije, Perani, Nikolina, Kal ec, Nikolina, Vinkovi Vr ek, Ivana

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  4. 4
    Luminescent pyrenyl-GNA nucleosides: synthesis, photophysics and confocal microscopy studies in cancer HeLa cells

    Luminescent pyrenyl-GNA nucleosides: synthesis, photophysics and confocal microscopy studies in cancer HeLa cells by Skiba, Joanna, Kowalczyk, Aleksandra, Fik, Marta A, Gapi ska, Magdalena, Trzybi ski, Damian, Wo niak, Krzysztof, Vr ek, Valerije, Czerwieniec, Rafa, Kowalski, Konrad

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  5. 5
    The stability of nitrogen-centered radicalsElectronic supplementary information (ESI) available. See DOI: 10.1039/c4ob01656d

    The stability of nitrogen-centered radicalsElectronic supplementary information (ESI) available. See DOI: 10.1039/c4ob01656d by Hioe, Johnny, Šaki, Davor, Vr ek, Valerije, Zipse, Hendrik

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  6. 6
    Structural and electronic determinants of flavonoid binding to human serum albumin: an extensive ligand-based study

    Structural and electronic determinants of flavonoid binding to human serum albumin: an extensive ligand-based study by Rimac, Hrvoje, Debeljak, eljko, Šaki, Davor, Weitner, Tin, Gabri evi, Mario, Vr ek, Valerije, Zorc, Branka, Boji, Mirza

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  7. 7
    A computational study of the chlorination and hydroxylation of amines by hypochlorous acidElectronic supplementary information (ESI) available: Energies and geometries for all structures calculated at different levels of theory, different water configurations calculated for selected transition state structures, numerical analyses and additional MD simulation data. See DOI: 10.1039/c5ob01823d

    A computational study of the chlorination and hydroxylation of amines by hypochlorous acidElectronic supplementary information (ESI) available: Energies and geometries for all stru... by Šaki, Davor, Han eva ki, Marko, Smith, David M, Vr ek, Valerije

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  8. 8
    Biomimetic rearrangement of the 2-cyclopentyl-2-propyl cation

    Biomimetic rearrangement of the 2-cyclopentyl-2-propyl cation by Vrček, Valerije, Siehl, Hans-Ullrich, Kronja, Olga

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  9. 9
    Interaction of L-ascorbate with substituted nitrosobenzenes. Role of the ascorbate 2-OH group in antioxidant reactions

    Interaction of L-ascorbate with substituted nitrosobenzenes. Role of the ascorbate 2-OH group in antioxidant reactions by Uršić, Stanko, Vrček, Valerije, Ljubas, Danijel, Ivana Vinković, and

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  10. 10
    Predictions of 13C chemical shifts in carbocations. The use of scaled chemical shifts calculated using GIAO DFT methods

    Predictions of 13C chemical shifts in carbocations. The use of scaled chemical shifts calculated using GIAO DFT methods by Vrček, Valerije, Kronja, Olga, Siehl, Hans-Ullrich

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  11. 11
    Reactions of the carbonyl group with nitroso compounds. The cases of pyruvic acid and acetaldehyde

    Reactions of the carbonyl group with nitroso compounds. The cases of pyruvic acid and acetaldehyde by URSIC, S, PILEPIC, V, VRCEK, V, GABRICEVIC, M, ZORC, B

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  12. 12
    Reaction of pyruvic acid with nitrosobenzenes

    Reaction of pyruvic acid with nitrosobenzenes by URSIC, S, VRCEK, V, GABRICEVIC, M, ZORC, B

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