Peter's research - selected topics; for more details see my publications
| [1] I use electronic structure calculations to
identify chemical reaction
determinants, as in this C-oxidation reaction, catalyzed by metallo-enzymes of the Xanthine Dehydrogenase family: |
![]() the enzyme the cofactor a reaction model |
| [2] When teaching organic chemistry I think of the
ways to make it easier for students. In this example I am using the recursive
language properties of Symbolic Organic Chemistry reactions: |
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| [3] Students are great research collaborators: in this reaction (scheme), my students tested the ability of aromatic derivatives to scavenge solvated electrons and found a good agreement with the de/activating power of resident groups: |
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