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Efficient Samarium-Grafted-C3N4-Doped α-MoO3 Used as a Dye Degrader and Antibacterial Agent: In Silico Molecular Docking Study

  • Dades identificatives

    Identificador: imarina:9331192
    Autors:
    Shabbir, MImran, MHaider, AShahzadi, IAhmad, WUl-Hamid, ANabgan, WShahzadi, AAl-Shanini, AAl-Anazy, MMAdam, MIkram, M
    Resum:
    This study was used to evaluate the catalytic activity (CA) and bactericidal activity of alpha-MoO3 and Sm-g-C3N4-doped alpha-MoO3 composites prepared through an efficient, cost-effective coprecipitation route. Their characteristic studies verify the formation of alpha-MoO3 and its composites (3, 6, and 9 mL Sm-g-C3N4-doped alpha-MoO3), which showed high crystallinity, as confirmed by X-ray diffraction (XRD) analysis. The production of superoxide and hydroxyl radicals due to charge transfer through alpha-MoO3 and g-C3N4 eventually forms electrons in g-C3N4 and holes around alpha-MoO3. CA against Rhodamine B (RhB) in basic medium provides maximum results compared to acidic and neutral media. The bactericidal efficacy of the (9 mL) doped sample represents a greater inhibition zone of 6.10 mm against the negative bacterial strain Escherichia coli. Furthermore, in silico studies showed that the generated nanorods may inhibit DNA gyrase and dihydropteroate synthase (DHPS) enzymes.
  • Altres:

    Autor segons l'article: Shabbir, M; Imran, M; Haider, A; Shahzadi, I; Ahmad, W; Ul-Hamid, A; Nabgan, W; Shahzadi, A; Al-Shanini, A; Al-Anazy, MM; Adam, M; Ikram, M
    Departament: Enginyeria Química
    Autor/s de la URV: Nabgan, Walid
    Paraules clau: Water Vacancy Reduction Photocatalytic degradation Nanoparticles Nanocomposites Moo3 nanobelts H-moo3 Growth Composite
    Resum: This study was used to evaluate the catalytic activity (CA) and bactericidal activity of alpha-MoO3 and Sm-g-C3N4-doped alpha-MoO3 composites prepared through an efficient, cost-effective coprecipitation route. Their characteristic studies verify the formation of alpha-MoO3 and its composites (3, 6, and 9 mL Sm-g-C3N4-doped alpha-MoO3), which showed high crystallinity, as confirmed by X-ray diffraction (XRD) analysis. The production of superoxide and hydroxyl radicals due to charge transfer through alpha-MoO3 and g-C3N4 eventually forms electrons in g-C3N4 and holes around alpha-MoO3. CA against Rhodamine B (RhB) in basic medium provides maximum results compared to acidic and neutral media. The bactericidal efficacy of the (9 mL) doped sample represents a greater inhibition zone of 6.10 mm against the negative bacterial strain Escherichia coli. Furthermore, in silico studies showed that the generated nanorods may inhibit DNA gyrase and dihydropteroate synthase (DHPS) enzymes.
    Àrees temàtiques: Química Interdisciplinar General chemistry General chemical engineering Engenharias ii Ciências agrárias i Chemistry, multidisciplinary Chemistry (miscellaneous) Chemistry (all) Chemical engineering (miscellaneous) Chemical engineering (all)
    Accès a la llicència d'ús: https://creativecommons.org/licenses/by/3.0/es/
    Adreça de correu electrònic de l'autor: walid.nabgan@urv.cat
    Identificador de l'autor: 0000-0001-9901-862X
    Data d'alta del registre: 2024-08-03
    Versió de l'article dipositat: info:eu-repo/semantics/publishedVersion
    Enllaç font original: https://pubs.acs.org/doi/10.1021/acsomega.3c03910
    URL Document de llicència: https://repositori.urv.cat/ca/proteccio-de-dades/
    Referència a l'article segons font original: Acs Omega. 8 (38): 34805-34815
    Referència de l'ítem segons les normes APA: Shabbir, M; Imran, M; Haider, A; Shahzadi, I; Ahmad, W; Ul-Hamid, A; Nabgan, W; Shahzadi, A; Al-Shanini, A; Al-Anazy, MM; Adam, M; Ikram, M (2023). Efficient Samarium-Grafted-C3N4-Doped α-MoO3 Used as a Dye Degrader and Antibacterial Agent: In Silico Molecular Docking Study. Acs Omega, 8(38), 34805-34815. DOI: 10.1021/acsomega.3c03910
    DOI de l'article: 10.1021/acsomega.3c03910
    Entitat: Universitat Rovira i Virgili
    Any de publicació de la revista: 2023
    Tipus de publicació: Journal Publications
  • Paraules clau:

    Chemical Engineering (Miscellaneous),Chemistry (Miscellaneous),Chemistry, Multidisciplinary
    Water
    Vacancy
    Reduction
    Photocatalytic degradation
    Nanoparticles
    Nanocomposites
    Moo3 nanobelts
    H-moo3
    Growth
    Composite
    Química
    Interdisciplinar
    General chemistry
    General chemical engineering
    Engenharias ii
    Ciências agrárias i
    Chemistry, multidisciplinary
    Chemistry (miscellaneous)
    Chemistry (all)
    Chemical engineering (miscellaneous)
    Chemical engineering (all)
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