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  1. 1
    The Melatonin Conformer Space: Benchmark and Assessment of Wave Function and DFT Methods for a Paradigmatic Biological and Pharmacological Molecule

    The Melatonin Conformer Space: Benchmark and Assessment of Wave Function and DFT Methods for a Paradigmatic Biological and Pharmacological Molecule von Fogueri, Uma R, Kozuch, Sebastian, Karton, Amir, Martin, Jan M.L


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  2. 2
    A simple DFT-based diagnostic for nondynamical correlation

    A simple DFT-based diagnostic for nondynamical correlation von Fogueri, Uma R., Kozuch, Sebastian, Karton, Amir, Martin, Jan M. L.

    Veröffentlicht in Theoretical chemistry accounts

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