Quantum mechanical/molecular mechanical study on the mechanisms of Compound I formation in the catalytic cycle of chloroperoxidase: An overview on heme enzymes

  • Hui Chen
  • , Hajime Hirao
  • , Etienne Derat
  • , Ilme Schlichting
  • , Sason Shaik*
    • *Corresponding author for this work

Research output: Contribution to journal › Article › peer-review

62 Scopus citations

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Chemistry

Pharmacology, Toxicology and Pharmaceutical Science

Biochemistry, Genetics and Molecular Biology

Immunology and Microbiology