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Ternary system cationic copolymer (dimethylaminoethyl methacrylate: Butyl methacrylate)/thioglycolic acid doped copper tungstate nanocomposite for environmental remediation and pathogen control supported by molecular docking analysis

dc.contributor.authorMohamed Kadie, Abdikani Hussein
dc.contributor.authorHaider, Ali
dc.contributor.authorShahzadi, Anum
dc.contributor.authorUl-Hamid, Anwar
dc.contributor.authorUllah, Hameed [UNESP]
dc.contributor.authorAyari-Akkari, Amel
dc.contributor.authorMateen, Zernab
dc.contributor.authorIkram, Muhammad
dc.contributor.institutionGovernment College University Lahore
dc.contributor.institutionUniversity of Agriculture
dc.contributor.institutionCOMSATS University Islamabad
dc.contributor.institutionKing Fahd University of Petroleum & Minerals
dc.contributor.institutionUniversidade Estadual Paulista (UNESP)
dc.contributor.institutionKing Khalid University
dc.date.accessioned2025-04-29T19:35:47Z
dc.date.issued2025-07-01
dc.description.abstract2 and 4 wt % of cationic copolymer (dimethylaminoethyl methacrylate: butyl methacrylate) designed eudragit (Eud) with a fixed quantity of thioglycolic acid (TGA) doped copper tungstate (CuWO4) nanocomposite (NC) were prepared using a co-precipitation approach. A range of characterization techniques was employed to analyze the structural, optical, and compositional characteristics of prepared NC. XRD analysis confirmed the monoclinic and anorthic crystal structure of CuWO4, addition of Eud and TGA resulted in increased crystallinity of CuWO4. FTIR spectra verified the presence of vibrational modes related to CuWO4. The electronic spectra demonstrated an increased absorption window and redshift with Eud and TGA, leading to the reduction in bandgap energy (Eg). FESEM analysis elucidates the flakes and rod-like structures on the surface of CuWO4 with dopants. 4 wt % Eud/TGA-CuWO4 revealed a significant reduction of methyl orange (MO) dye in a neutral medium. Furthermore, the bactericidal effectiveness was tested against S. aureus, demonstrating a remarkable inhibition zone (7.35 mm). The mechanism behind the bactericidal action of TGA-CuWO4, Eud/TGA-CuWO4 NC against DNA gyrase S. aureus (Gram + ve) was studied using molecular docking.en
dc.description.affiliationSolar Cell Applications Research Lab Department of Physics Government College University Lahore, Punjab
dc.description.affiliationDepartment of Clinical Medicine Faculty of Veterinary and Animal Sciences Muhammad Nawaz Shareef University of Agriculture, Punjab
dc.description.affiliationFaculty of Pharmacy COMSATS University Islamabad, Lahore Campus
dc.description.affiliationCore Research Facilities King Fahd University of Petroleum & Minerals
dc.description.affiliationDepartment of Physics and Meteorology School of Sciences Sao Paulo State University (UNESP), Bauru
dc.description.affiliationBiology Department College of Science King Khalid University, P.O. Box 960
dc.description.affiliationUnespDepartment of Physics and Meteorology School of Sciences Sao Paulo State University (UNESP), Bauru
dc.identifierhttp://dx.doi.org/10.1016/j.matchemphys.2025.130635
dc.identifier.citationMaterials Chemistry and Physics, v. 338.
dc.identifier.doi10.1016/j.matchemphys.2025.130635
dc.identifier.issn0254-0584
dc.identifier.scopus2-s2.0-86000641838
dc.identifier.urihttps://hdl.handle.net/11449/304720
dc.language.isoeng
dc.relation.ispartofMaterials Chemistry and Physics
dc.sourceScopus
dc.subjectCo-precipitation
dc.subjectDye decolorization
dc.subjectMolecular docking
dc.subjectS. aureus
dc.titleTernary system cationic copolymer (dimethylaminoethyl methacrylate: Butyl methacrylate)/thioglycolic acid doped copper tungstate nanocomposite for environmental remediation and pathogen control supported by molecular docking analysisen
dc.typeArtigopt
dspace.entity.typePublication
relation.isOrgUnitOfPublicationaef1f5df-a00f-45f4-b366-6926b097829b
relation.isOrgUnitOfPublication.latestForDiscoveryaef1f5df-a00f-45f4-b366-6926b097829b
unesp.author.orcid0000-0002-2876-3996[2]
unesp.author.orcid0000-0002-0259-301X[4]
unesp.author.orcid0000-0001-7741-789X[8]
unesp.campusUniversidade Estadual Paulista (UNESP), Faculdade de Ciências, Baurupt

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