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Работы, цитирующие эту работу

Работ: 9

Работа: 6‐31G* basis set for third‐row atoms

  1. Designing a graphene nanoflake for the adsorption of pyrazinamide antimicrobial drug to be used as a potential delivery platform based on DFT assessments

    Chou‐Yi Hsu, Hadil Faris Alotaibi, Shahad Mohammed Dhiaa Younis +4

    СтатьяGraphene and Nanomaterials ApplicationsMicrochemical Journal2025Цитирований: 1
    ABI

  2. A theoretical investigation of substituent effects on the stability and reactivity of N-heterocyclic olefin carboxylates

    Liang Dong, Jun Wen, Weiyi Li

    СтатьяChemical Reaction MechanismsOrganic & Biomolecular Chemistry2015Цитирований: 0
    ABI

  3. A mechanistic study on guanidine-catalyzed chemical fixation of CO<sub>2</sub>with 2-aminobenzonitrile to quinazoline-2,4(1H,3H)-dione

    Weiyi Li, Na Yang, Ya-Jing Lyu

    СтатьяCarbon dioxide utilization in catalysisOrganic Chemistry Frontiers2016Цитирований: 0
    ABI

  4. Exploring the effect of hydroxylic and non-hydroxylic solvents on the reaction of [V<sup>IV</sup>O(β-diketonate)<sub>2</sub>] with 2-aminobenzoylhydrazide in aerobic and anaerobic conditions

    Nirmalendu Biswas, Debashis Patra, Bipul Mondal +7

    СтатьяVanadium and Halogenation ChemistryDalton Transactions2017Цитирований: 0
    ABI

  5. Modification of a H-terminated silicon surface by organic sulfide molecules: the mechanism and origin of reactivity

    Na Yang, Weiyi Li, Liang Dong

    СтатьяMolecular Junctions and NanostructuresNew Journal of Chemistry2020Цитирований: 0
    ABI

  6. An enhanced adsorption of paracetamol drug using the iron-encapsulated boron carbide nanocage: DFT outlook

    Mohamed J. Saadh, Mustafa Nasrat Abdulraheem, Hanan Hassan Ahmed +7

    СтатьяBoron and Carbon Nanomaterials ResearchComputational and Theoretical Chemistry2023Цитирований: 0
    ABI

  7. Assessments of carbon and boron nitride graphdiyne nanosheets for exploring the amphetamine drug adsorbents/sensors along with density functional theory

    Mohamed J. Saadh, Sura Mohammad Mohealdeen, Chou‐Yi Hsu +5

    СтатьяGraphene research and applicationsChemical Physics Impact2023Цитирований: 0
    ABI

  8. Assessing the metronidazole adsorption by an iron-enhanced nanocone along with DFT calculations regarding the conjugated system formations for developing the drug delivery platforms

    Chou‐Yi Hsu, Mohamed J. Saadh, A.F. Mutee +6

    СтатьяNonlinear Optical Materials ResearchInorganic Chemistry Communications2024Цитирований: 0
    ABI

  9. A DFT study of eugenol adsorption onto pure and Si-doped Al12N12 and B12N12 fullerene-like nanocages

    Vincent de Paul Zoua, Fritzgerald Kogge Bine, Ismaèl Figapka Pagoré +2

    СтатьяBoron and Carbon Nanomaterials ResearchComputational and Theoretical Chemistry2024Цитирований: 0
    ABI