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Kaxiras’s Porphyrin: DFT Modeling of Redox-Tuned Optical and Electronic Properties in a Theoretically Designed Catechol-Based Bioinspired Platform

A detailed computational investigation of the 5,6-dihydroxyindole (DHI)-based porphyrin-type tetramer first described by Kaxiras as a theoretical structural model for eumelanin biopolymers is reported herein, with a view to predicting the technological potential of this unique bioinspired tetracatec...

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Detalles Bibliográficos
Autores principales: Crescenzi, Orlando, d’Ischia, Marco, Napolitano, Alessandra
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2017
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6352670/
https://www.ncbi.nlm.nih.gov/pubmed/31105182
http://dx.doi.org/10.3390/biomimetics2040021