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Photochemistry of Thymine in Protic Polar Nanomeric Droplets Using Electrostatic Embeding TD-DFT/MM

Thymine photochemistry is important for understanding DNA photodamage. In the gas phase, thymine undergoes a fast non-radiative decay from S [Formula: see text] to S [Formula: see text] . In the S [Formula: see text] state, it gets trapped for several picoseconds until returning to the ground-state...

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Detalles Bibliográficos
Autor principal: Huix-Rotllant, Miquel
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8513085/
https://www.ncbi.nlm.nih.gov/pubmed/34641565
http://dx.doi.org/10.3390/molecules26196021