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Structure–antioxidant activity relationships of dendrocandin analogues determined using density functional theory

Quantum-chemical calculations based on the density functional theory (DFT) at the B3LYP/6–311 + + G(2d,2p)//B3LYP/6–31G(d,p) level were employed to study the relationship between the antioxidant properties and chemical structures of six dendrocandin (DDCD) analogues in the gas phase and two solvents...

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Detalles Bibliográficos
Autores principales: Zhang, Ning, Wu, Yilong, Qiao, Miao, Yuan, Wenjuan, Li, Xingyu, Wang, Xuanjun, Sheng, Jun, Zi, Chengting
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer US 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8855351/
https://www.ncbi.nlm.nih.gov/pubmed/35194353
http://dx.doi.org/10.1007/s11224-022-01895-2