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Theoretical Models on the Cu2O2 Torture Track:  Mechanistic Implications for Oxytyrosinase and Small-Molecule Analogues

Electronic Structure - Modeling Properties

Publication Details

  • Authors: C.J. Cramer, M. Wloch, P. Piecuch, C. Puzzarini, and L. Gagliardi
  • Publication Number: 59
  • Year: 2006
  • Journal: J. Phys. Chem. A

Full Citation

C.J. Cramer, M. Wloch, P. Piecuch, C. Puzzarini, and L. Gagliardi, Theoretical Models on the Cu2O2 Torture Track:  Mechanistic Implications for Oxytyrosinase and Small-Molecule Analogues, J. Phys. Chem. A, 2006, 110, 1991–2004. DOI: 10.1021/jp056791e