Author

Archana Tomer

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Open access Jul 2026

Computational Grasp on Thiadiazole–Oxadiazole Schiff Bases: DFT, ADMET, Molecular Docking, Molecular Dynamics and In Vitro Evaluation of Antibacterial and Cytotoxic Activities

Two novel Schiff bases, PGPS and PGPO, were synthesized using phenyl glyoxal with substituted thiodiazole/oxadiazole, and their molecular structures were substantiated through a combination of spectral analysis and density functional theory.

Archana Tomer, Smriti Bansal, Vishnu Vats et al. · ChemistrySelect · 0 citations