Predicting pK(a) values of substituted phenols from atomic charges: comparison of different quantum mechanical methods and charge distribution schemes (Q44103023)

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scientific article published in August 2011
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Predicting pK(a) values of substituted phenols from atomic charges: comparison of different quantum mechanical methods and charge distribution schemes
scientific article published in August 2011

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    Predicting pK(a) values of substituted phenols from atomic charges: comparison of different quantum mechanical methods and charge distribution schemes (English)
    Ondrej Skrehota
    Michal Kudera
    Tomás Bouchal
    Heinrich J Huber
    1 August 2011
    1795-1806

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