Exploring smart drug delivery platforms through the adsorption of chlormethine anticancer by an iron-enhanced metallofullerene

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dc.authoridhttps://orcid.org/0000-0001-9346-4901
dc.authorscopusid13204227300
dc.authorwosidL-1534-2017
dc.contributor.authorSaadh, M.J.
dc.contributor.authorDhiaa, S.M.
dc.contributor.authorHussein, A.H.A.
dc.contributor.authorKarim, M.M.
dc.contributor.authorIdan, A.H.
dc.contributor.authorMirzaei, M.
dc.contributor.authorMosaddad, S.A.
dc.contributor.authorSalem-Bekhit, M.M.
dc.date.accessioned2024-08-27T11:34:55Z
dc.date.available2024-08-27T11:34:55Z
dc.date.issued2024
dc.departmentFakülteler, Mühendislik Fakültesi, Mühendislik Temel Bilimleri Bölümü
dc.description.abstractRepresentative iron-enhanced metallofullerenes including FeC24, FeC23, and FeC22 models were assessed for the adsorption of chlormethine (CMT) anticancer towards the development of smart drug delivery platforms. To this aim, density functional theory (DFT) calculations were performed to examine the structural and electronic features of models in the singular and conjugated states. Formations of CMT@FeC24, CMT@FeC23, and CMT@FeC22 conjugated complex systems were achieved by a major role of iron-enhanced region for making successful communications with the CMT substance. Two configurations were found for each conjugated complex system by the CMT relaxation at the metallofullerenes with meaningful results for adsorbing, retaining, and releasing processes of the adsorbed drug. The results of electronic features showed possibility of conducting a sensing function for the metallofullerenes during the adsorption of CMT substance. Consequently, the investigated conjugated complex systems were proposed towards the development of smart drug delivery platforms especially by the formation of CMT@FeC22 system.
dc.identifier.citationM.J. Saadh, S.M. Dhiaa, A.H.A. Hussein, M.M. Karim, A.H. Idan, M. Mirzaei, S.A. Mosaddad, M.M. Salem-Bekhit, (2024). Exploring smart drug delivery platforms through the adsorption of chlormethine anticancer by an iron-enhanced metallofullerene, Journal of the Indian Chemical Society,101 (10). Erişim adresi: https://doi.org/10.1016/j.jics.2024.101294
dc.identifier.doi10.1016/j.jics.2024.101294
dc.identifier.endpage8en_US
dc.identifier.issn0019-4522
dc.identifier.issue10en_US
dc.identifier.scopus2-s2.0-85200148503
dc.identifier.scopusqualityQ3
dc.identifier.startpage1en_US
dc.identifier.urihttps://doi.org/10.1016/j.jics.2024.101294
dc.identifier.urihttps://hdl.handle.net/20.500.13099/371
dc.identifier.volume101en_US
dc.identifier.wosWOS:001288767600001
dc.identifier.wosqualityQ2
dc.indekslendigikaynakWeb of Science
dc.indekslendigikaynakScopus
dc.institutionauthorMirzaei, Mahmoud
dc.language.isoen
dc.publisherElsevier
dc.relation.ispartofJournal of the Indian Chemical Society
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı
dc.rightsinfo:eu-repo/semantics/closedAccess
dc.subjectAnticancer drug delivery
dc.subjectFullerene
dc.subjectIron doping
dc.subjectSensing function
dc.subjectStructural analysis
dc.subjectchlormethine
dc.subjectfullerene
dc.subjectiron
dc.subjectArticle
dc.subjectcancer inhibition
dc.subjectdensity functional theory
dc.subjectdrug adsorption
dc.subjectdrug delivery system
dc.titleExploring smart drug delivery platforms through the adsorption of chlormethine anticancer by an iron-enhanced metallofullerene
dc.typeArticle

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