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51 ta ish

Ish: Structural Characterization, Computational Analysis, NCI, and Molecular Docking Studies of Bi-Imidazole-Based Heterocycles Synthesized via ZnO Nanocatalysis

  1. Photoluminescence property and solvation studies on (E)-N-(pyrimidin-2yl)-4-((3,4,5-trimethoxy benzylidede) amino) benzene sulfonamide; Synthesis, structural, topological analysis, antimicrobial activity and molecular docking studies

    N. Elangovan, Suliman Yousef Alomar, S. Sowrirajan +3

    Maqola20232 iqtibos
    ABI

  2. Synthesis of novel naphthalene-chimonanthine scaffolds hybrids with potent antibacterial or antifungal activity

    Shaojun Zheng, WU Wen-bin, Qiaoju Jiang +5

    Maqola20222 iqtibos
    ABI

  3. Molecular Docking and Comparative Vibrational Spectroscopic Analysis, HOMO-LUMO, Polarizabilities, and Hyperpolarizabilities of <i>N</i>-(4-Bromophenyl)-4-Nitrobenzamide by Different DFT (B3LYP, B3PW91, and MPW1PW91) Methods

    Apoorva Dwivedi, Abhishek Kumar

    Maqola20192 iqtibos
    ABI

  4. Schiff base (Z)-4-((furan-2-ylmethylene)amino) benzenesulfonamide: Synthesis, solvent interactions through hydrogen bond, structural and spectral properties, quantum chemical modeling and biological studies

    S. Manivel, Bhavya Gangadharappa, N. Elangovan +3

    Maqola20222 iqtibos
    ABI

  5. Synthesis, characterization, antibacterial, antifungal and antithrombotic activity studies of new chiral selenated Schiff bases and their Pd complexes

    PrabhuKumar K.M., Satheesh C.E., P. Raghavendra Kumar +4

    Maqola20222 iqtibos
    ABI

  6. Spectroscopic characterization (IR, UV-Vis), and HOMO-LUMO, MEP, NLO, NBO Analysis and the Antifungal Activity for 4-Bromo-N-(2-nitrophenyl) benzamide; Using DFT Modeling and In silico Molecular Docking

    Suzan K. Alghamdi, Faheem Abbas, Rageh K. Hussein +2

    Maqola20222 iqtibos
    ABI

  7. Synthesis, in-vitro α-glucosidase inhibition and molecular docking studies of 1,3,4-thiadiazole-5,6-diphenyl-1,2,4-triazine hybrids: Potential leads in the search of new antidiabetic drugs

    Hariom Kumar, Manoj Dhameja, Sirisha Kurella +2

    Maqola20222 iqtibos
    ABI

  8. Investigations on the non-covalent interactions, drug-likeness, molecular docking and chemical properties of 1,1,4,7,7- pentamethyldiethylenetriammonium trinitrate by density-functional theory

    Mouna Medimagh, Noureddine Issaoui, Sofian Gatfaoui +5

    Maqola20232 iqtibos
    ABI

  9. Synthesis, vibrational analysis, absorption and emission spectral studies, topology and molecular docking studies on sulfadiazine derivative

    N. Elangovan, S. Sowrirajan, Natarajan Arumugam +3

    Maqola20242 iqtibos
    ABI

  10. Synthesis, computational, reactivity analysis, non-covalent interaction and docking studies on (N1E,N2E)-N1,N2-bis(2,4-dichlorobenzylidene)-4-methylbenzene-1,2-diamine

    N. Elangovan, T. Sankar Ganesan, A. Vishveshwaran +4

    Maqola20242 iqtibos
    ABI

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