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Harnessing thiazole chemistry for antifungal strategies through an experimental and computational chemistry approach: anti-biofilm, molecular docking, dynamics, and DFT analysis.
Shinde RA, Adole VA, Patil RH, Khairnar BB, Jagdale BS, Almutairi TM, Patel H, Islam MS, Ahmad I, Kumar AR, Selvaraj S, Pawar TB, Alam M. Shinde RA, et al. Among authors: jagdale bs. RSC Adv. 2025 Jun 26;15(27):21838-21858. doi: 10.1039/d5ra00657k. eCollection 2025 Jun 23. RSC Adv. 2025. PMID: 40575561 Free PMC article.
Synthesis, Spectroscopic Characterization, Structural Analysis, Antimycobacterial Study, Molecular Docking, DFT, and ADME Studies of Novel Hybrid Pyrrole-Pyrazole-Piperazine Chalcone.
Deshmukh HS, Adole VA, Shinde RA, Yasin HKA, Mali SN, Misra N, Seetharaman J, Kumar A, Jagdale BS. Deshmukh HS, et al. Among authors: jagdale bs. ACS Omega. 2025 Oct 13;10(42):49623-49640. doi: 10.1021/acsomega.5c04366. eCollection 2025 Oct 28. ACS Omega. 2025. PMID: 41179173 Free PMC article.
Green Synthesis of Pyrazole Linked Thiazole Derivatives With Enhanced Anti-Breast Cancer Activity: Water Extract of Banana Peel-Mediated Protocol, Anticancer Screening, Epidermal Growth Factor Receptor Inhibition, In Silico Absorption-Distribution-Metabolism-Excretion and Density Functional Theory Calculations.
Vahora A, Singh V, Deshmukh HS, Adole VA, Mali SN, Shah U, Mukherjee A, Shah H, Sarkar R, Pawar TB, Jagdale BS. Vahora A, et al. Among authors: jagdale bs. Chem Biodivers. 2025 Aug;22(8):e202402791. doi: 10.1002/cbdv.202402791. Epub 2025 May 10. Chem Biodivers. 2025. PMID: 40254723
Efficient synthesis, dual anti-tubercular and antioxidant activity of triazole-acetophenone derivatives: enhanced efficacy via esterification and quantum mechanical validation of CYP121 binding.
Jagtap RA, Jagdale BS, Dhonnar SL, Shaikh SA, More RA, Alavala RR, Muteeb G, Fernandez-Conde D, Pawar TJ, Meshram RJ, Escobar-Cabrera J, Chobe SS. Jagtap RA, et al. Among authors: jagdale bs. RSC Adv. 2026 Jan 15;16(4):3609-3622. doi: 10.1039/d5ra09368f. eCollection 2026 Jan 13. RSC Adv. 2026. PMID: 41550807 Free PMC article.
11 results