Molecular Modeling Based on Time-Dependent Density Functional Theory (TD-DFT) Applied to the UV-Vis Spectra of Natural Compounds

Molecular Modeling Based on Time-Dependent Density Functional Theory (TD-DFT) Applied to the UV-Vis Spectra of Natural Compounds

As diseases caused by solar radiation have gained great prominence, several methods to prevent them have been developed. Among the most common, the use of sunscreens is customary and accessible. The application of theoretical methods has helped to design new compounds with therapeutic and protective...

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Bibliographic Details
Main Authors: João Otávio Anhaia-Machado, Artur Caminero Gomes Soares, Claudinéia Aparecida Sales de Oliveira Pinto, Andres Ignacio Ávila Barrera, André Rolim Baby, Gustavo Henrique Goulart Trossini
Format: Article
Language:English
Published: MDPI AG 2022-12-01
Series:Chemistry
Subjects:
photoprotectors
natural products
molecular modeling
time-dependent density functional theory (TD-DFT)
UV
Online Access:https://www.mdpi.com/2624-8549/5/1/4

Internet

https://www.mdpi.com/2624-8549/5/1/4

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