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Empirical Valence Bond Simulations of the Hydride-Transfer Step in the Monoamine Oxidase A Catalyzed Metabolism of Noradrenaline.
Poberznik, Matic; Purg, Miha; Repic, Matej; Mavri, Janez; Vianello, Robert.
Afiliação
  • Poberznik M; Department of Physical and Organic Chemistry, Jozef Stefan Institute , Jamova cesta 39, SI-1000 Ljubljana, Slovenia.
  • Purg M; Department of Cell and Molecular Biology, Uppsala Biomedical Centre , Husargatan 3, S-75124 Uppsala, Sweden.
  • Repic M; Laboratory for Biocomputing and Bioinformatics, National Institute of Chemistry , Hajdrihova ulica 19, SI-1000 Ljubljana, Slovenia.
  • Mavri J; Laboratory for Biocomputing and Bioinformatics, National Institute of Chemistry , Hajdrihova ulica 19, SI-1000 Ljubljana, Slovenia.
  • Vianello R; Computational Organic Chemistry and Biochemistry Group, Ruder Boskovic Institute , Bijenicka cesta 54, HR-10000 Zagreb, Croatia.
J Phys Chem B ; 120(44): 11419-11427, 2016 11 10.
Article em En | MEDLINE | ID: mdl-27734680
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Base de dados: MEDLINE Assunto principal: Norepinefrina / Simulação de Dinâmica Molecular / Monoaminoxidase Idioma: En Ano de publicação: 2016 Tipo de documento: Article
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Base de dados: MEDLINE Assunto principal: Norepinefrina / Simulação de Dinâmica Molecular / Monoaminoxidase Idioma: En Ano de publicação: 2016 Tipo de documento: Article