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Spin-dependent mechanism for diatomic ligand binding to heme
The nature of diatomic ligand recombination in heme proteins is elucidated by using a Landau–Zener model for the electronic coupling in the recombination rate constant. The model is developed by means of explicit potential energy surfaces calculated by using density functional theory (DFT). The inte...
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| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
National Academy of Sciences
2002
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| Schlagworte: | |
| Online Zugang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC139216/ https://ncbi.nlm.nih.gov/pubmed/12477933 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.252590999 |
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