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Please use this identifier to cite or link to this item: https://dspace.ffh.bg.ac.rs/handle/123456789/534
DC FieldValueLanguage
dc.contributor.authorAvdovic, Edina H.en_US
dc.contributor.authorDimić, Dušanen_US
dc.contributor.authorMilanovic, Ziko B.en_US
dc.contributor.authorRadulovic, Milankaen_US
dc.contributor.authorStanojevic Pirkovic, Marijanaen_US
dc.date.accessioned2022-12-15T16:09:27Z-
dc.date.available2022-12-15T16:09:27Z-
dc.date.issued2021-01-01-
dc.identifier.isbn9781665442619-
dc.identifier.urihttps://dspace.ffh.bg.ac.rs/handle/123456789/534-
dc.description.abstractSynthetic coumarins are a class of compounds with promising biological functions. The structure of the 4-hydroxycoumarin derivative, 3-(1-(4-hydroxyphenyl)amino) ethylidene) chroman-2,4-dione, and its corresponding Pd complex, are described in this contribution. Inter- and intramolecular interactions governing stability were analyzed by the Natural Bond Orbital and Quantum Theory of Atoms in Molecules approaches. The antimicrobial activity towards several microorganisms was assessed and differences in activity towards Escherichia coli DNA Gyrase B enzyme were investigated by molecular docking.en
dc.relation.ispartofBIBE 2021 - 21st IEEE International Conference on BioInformatics and BioEngineering, Proceedingsen
dc.subjectantimicrobial activityen
dc.subjectcoumarinen
dc.subjectDFTen
dc.subjectmolecular dockingen
dc.subjectNBOen
dc.titleStructural, antimicrobial, and molecular docking study of 3-(1-(4-hydroxyphenyl)amino) ethylidene)chroman-2,4-dione and its corresponding Pd complexen_US
dc.typeConference Paperen_US
dc.identifier.doi10.1109/BIBE52308.2021.9635500-
dc.identifier.scopus2-s2.0-85123739746-
dc.identifier.urlhttps://api.elsevier.com/content/abstract/scopus_id/85123739746-
item.fulltextNo Fulltext-
item.openairetypeConference Paper-
item.cerifentitytypePublications-
item.openairecristypehttp://purl.org/coar/resource_type/c_18cf-
item.grantfulltextnone-
crisitem.author.orcid0000-0001-8127-5396-
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University of Belgrade
Faculty of Physical Chemistry
Studentski trg 12-16
11158 Belgrade 118
PAC 105305
SERBIA
University of Belgrade Faculty of Physical Chemistry