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

Tayyiaba IqbalDepartment of Chemistry, Abbottabad University of Science and Technology, Abbottabad, 22500, PakistanShoaib KhanDepartment of Chemistry, Abbottabad University of Science and Technology, Abbottabad, 22500, PakistanAsrar KhanDepartment of Chemistry, Abbottabad University of Science and Technology, Abbottabad, 22500, PakistanHassnain SajjadDepartment of Chemistry, Abbottabad University of Science and Technology, Abbottabad, 22500, PakistanMasi A. AlmalkiDepartment of Pharmacology and Toxicology, College of Pharmacy, Taif University, Taif, Saudi ArabiaSouhir AbidDepartment of Chemistry, College of Science, Jouf University, P.O. Box 2014, Sakaka, Aljouf, Kingdom of Saudi ArabiaMajdi AbidDepartment of Chemistry, College of Science, Jouf University, P.O. Box 2014, Sakaka, Aljouf, Kingdom of Saudi ArabiaSyed Kashif AliDepartment of Physical Sciences, Chemistry Division, College of Science, Jazan University, P.O. Box. 114, Jazan, 45142, Kingdom of Saudi ArabiaZaripov BakridinDepartment of Human and animal physiology, National University of Uzbekistan named after Mirzo Ulugbek, Tashkent, UzbekistanEshmuratov BaltabayDepartment of Forensic Medicine and Medical Law (first), Tashkent Medical Academy, Tashkent, UzbekistanSobhi M. GomhaDepartment of Chemistry, Faculty of Science, Islamic University of Madinah, Madinah, 42351, Saudi ArabiaMagdi E. A. ZakiDepartment of Chemistry, Faculty of Science, Imam Mohammad Ibn Saud Islamic University (IMSIU), Riyadh, 11623, Saudi Arabia
2026en

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