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51 ta ish

Ish: Computer-aided development of novel thiazolidinone–thiazole derivatives: multidimensional structure–activity relationships revealed by quantum chemical analysis, molecular docking and biological investigation

  1. SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules

    Antoine Daina, Olivier Michielin, Vincent Zoete

    MaqolaOchiq kirish201731 iqtibos
    ABI

  2. A new synthetic approach for determination of thiadiazole clubbed sulfonamide as diabetic therapeutic with in silico modeling and kinetic study

    Shoaib Khan, Tayyiaba Iqbal

    Maqola202512 iqtibos
    ABI

  3. IDF Diabetes Atlas: Global, regional and country-level diabetes prevalence estimates for 2021 and projections for 2045

    Hong Sun, Pouya Saeedi, Suvi Karuranga +17

    MaqolaOchiq kirish202110 iqtibos
    ABI

  4. Macromolecular scaffolds with nitrogen–sulfur motifs: Dual α-glucosidase and urease inhibition with molecular docking and mechanistic evaluation

    Shoaib Khan, Tayyiaba Iqbal, Kasim Sakran Abass +6

    Maqola202510 iqtibos
    ABI

  5. Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings 1PII of original article: S0169-409X(96)00423-1. The article was originally published in Advanced Drug Delivery Reviews 23 (1997) 3–25. 1

    Christopher A. Lipinski, Franco Lombardo, Beryl W. Dominy +1

    Sharh maqola20017 iqtibos
    ABI

  6. Enzyme kinetics-guided evaluation of thiazine hybrids targeting α-amylase and α-glucosidase with in vivo validation

    Aftab.Ahmad Khan, Shoaib Khan, Tayyiaba Iqbal +9

    MaqolaCarbohydrate Chemistry and SynthesisChemico-Biological Interactions20264 iqtibos
    ABI

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  10. Tailored pyrrole-based imidazothiazole scaffolds: Synthetic elaboration, enzyme kinetic profiling and DFT-guided molecular docking toward Antidiabetic therapeutics

    Zanib Fiaz, Shoaib Khan, Tayyiaba Iqbal +6

    MaqolaNatural Antidiabetic Agents StudiesComputational Biology and Chemistry20263 iqtibos
    ABI

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    Boshqa3 iqtibos
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  12. Integrated insight and in silico investigation of hybrid bis-thiazolidinone derivatives along with anti-Alzheimer activity

    Shoaib Khan, Tayyiaba Iqbal, Mujaddad Ur Rehman +3

    Maqola20253 iqtibos
    ABI

  13. Computationally driven discovery of thieno-pyridine thiadiazoles: a synthesis, DFT, docking and dynamics roadmap toward multitarget antidiabetic therapy

    Shoaib Khan, Mohamed A. Habib, Tayyiaba Iqbal +5

    MaqolaSynthesis and biological activityJournal of Computer-Aided Molecular Design20262 iqtibos
    ABI

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