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2026

Integrated 3D-QSAR, Molecular Docking, Molecular Dynamics, DFT, In Vitro, and In Vivo Evaluation of Benzylidene-Thiazolidinedione Derivatives as Aldose Reductase Inhibitors

Benzylidene-thiazolidinedione derivatives (SA01-SA12) were designed and synthesized using structure-based 3D-QSAR (R² = 0.819, Q² = 0.537) and pharmacophore modeling techniques to discover potent ALR2 inhibitors. Molecular docking analyses revealed that...

Anita Kumari, S. Verma, Preety Kumari et al. · 0 citations
Sep 2026

Molecular Developments in Antimicrobials Using Structural Analysis and SAR Studies

Antimicrobials are crucial for both the prevention and treatment of infectious diseases because they prevent bacteria from growing and surviving through a number of mechanisms. Developing successful treatment plans requires an understanding of how they work. The use of antibiotics and antiviral medications is very...

Rupali Kohal, Preety Kumari, S. Verma et al. · 0 citations

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