Computational Modeling of the Dehydrogenation of Methylamine
The reaction sequence early in the metabolism of methylamine by the dehydrogenase cofactor tryptophan tryptophyl quinone (TTQ) is investigated by a large series of density functional theory calculations. Free energy corrections are calculated at the reactant and intermediate geometries, and solvatio...
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| Publicado no: | Journal of the Mexican Chemical Society |
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| Principais autores: | , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Sociedad Química de México
2011
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| Assuntos: | |
| Acesso em linha: | https://www.redalyc.org/articulo.oa?id=47521267004 |
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