Abduljelil Ajala

Theoretical Investigation of Correlations Between Molecular and Electronic Structure and Antifungal Activity in Coumarin Derivatives: Combining Qsar and Dft Studies

Abduljelil Ajala, Adamu Uzairu, Idris O. Suleiman & Ahmed Jibrin Uttu · Journal of Advances in Medical and Pharmaceutical Sciences · 2018

Quantitative structure-activity relationship (QSAR) models were combined with density functional computations and used to predict anti-fungi activities in a series of coumarin derivatives. Essential descriptors employed in this study were chosen based on the use of the Genetic Fu...