Erik Hedegård
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- 2019
- Mechanism of hydrogen peroxide formation by lytic polysaccharide monooxygenase
- 2018
- Exploration of H2 binding to the [NiFe]-hydrogenase active site with multiconfigurational density functional theory
- Multiconfigurational short-range density-functional theory for open-shell systems
- 2017
- Relativistic Polarizable Embedding
- Multiscale Modelling of Lytic Polysaccharide Monooxygenases
- Modeling the absorption spectrum of the permanganate ion in vacuum and in aqueous solution
- Targeting the reactive intermediate in polysaccharide monooxygenases