DFT study and microbiology of some coumarin-based compounds containing a chalcone moiety

DFT study and microbiology of some coumarin-based compounds containing a chalcone moiety

In the present investigation, a series of coumarin-based compounds containing a chalcone moiety were studied for their in vitro and in silico properties. DFT global chemical reactivity descriptors (chemical hardness, total energy, electronic chemical potential and electrophilicity) are calc...

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Bibliographic Details
Main Authors: Špirtović-Halilović Selma, Salihović Mirsada, Džudžević-Čančar Hurija, Trifunović Snežana, Roca Sunčica, Softić Dženita, Završnik Davorka
Format: Article
Language:English
Published: Serbian Chemical Society 2014-01-01
Series:Journal of the Serbian Chemical Society
Subjects:
coumarins
chemical reactivity descriptors
antimicrobial activity
HOMO and LUMO studies
Online Access:http://www.doiserbia.nb.rs/img/doi/0352-5139/2014/0352-51391300077S.pdf

Internet

http://www.doiserbia.nb.rs/img/doi/0352-5139/2014/0352-51391300077S.pdf

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