Publications by the researcher in collaboration with Asad Syed (7)

2025

  1. Synergistic synthesis and computational analysis of novel indazole-2-Pyrone hybrids: Toxicity, Hirshfeld surface insights, and antiviral potential against HIV-1 and Coronaviruses

    Journal of Molecular Structure, Vol. 1321

2024

  1. Comprehensive study on the stereoselective epoxidation of aromatic atlantone: mechanism, ADME analysis, and potential as COVID-19 drug

    Chemistry of Heterocyclic Compounds, Vol. 60, Núm. 11, pp. 568-574

  2. Exploring the synthesis and application of a pyrazole derivative in corrosion protection: Theoretical modeling and experimental investigations

    Journal of Molecular Structure, Vol. 1312

  3. Investigating the chemical reactivity and molecular docking of 2-diazo-3,3,3-trifluoro-1-nitropropane with phenyl methacrylate using computational methods

    Chemistry of Heterocyclic Compounds, Vol. 60, Núm. 11, pp. 592-599

  4. Molecular docking, expounding the chemo-, regio-selectivity, and the mechanism of [3 + 2] cycloloaddition reaction between nitrile-imine and (thio)-chalcone

    Monatshefte fur Chemie, Vol. 155, Núm. 7, pp. 697-707

  5. Synthesis, X-ray analysis, and antiviral evaluation of allohimachalol: Insights into stereoselectivity in epoxidation

    Journal of Molecular Structure, Vol. 1305

2023

  1. Investigation of the molecular mechanism and diastereoselectivity in the [3 + 2] cycloaddition reaction between acetonitrile oxide and Cis-3,4-Dichlorocyclobutene: Insights from MEDT and docking study

    Computational and Theoretical Chemistry, Vol. 1228