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Challenging Density Functional Theory Calculations with Hemes and Porphyrins

In this paper we review recent advances in computational chemistry and specifically focus on the chemical description of heme proteins and synthetic porphyrins that act as both mimics of natural processes and technological uses. These are challenging biochemical systems involved in electron transfer...

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Detalles Bibliográficos
Autores principales:	de Visser, Sam P., Stillman, Martin J.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2016
Materias:	Review
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4848975/ https://www.ncbi.nlm.nih.gov/pubmed/27070578 http://dx.doi.org/10.3390/ijms17040519

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