Principal Component Analysis Based Solvent Map for Optimisation of Rate and Yield of Curcumin Synthesis

QSAR of antioxidant activity of some novel sulfonamide derivatives.

Chemical Reactivity Study of Anew of Suggested Chemotherapy Agent Using DFT

Electronic Structure, Global Reactivity Descriptors and Nonlinear Optical Properties of Some Novel pyrazolyl quinolinone Derivatives. DFT approach

Geometrical and Topological Descriptors for Activities Modeling of some Potent Inhibitors against Mycobacterium Tuberculosis: A Genetic Functional Approach

Qspr Models for The Prediction of Octanol/water Partition Coefficient of Organophosphorous Insecticides

Electronic Structure, Spectra and Chemical Reactivity Descriptors of Some Novel Rhodanine Derivatives. Density Functional Theory Approach

Synthesis, Electronic Structure, NLO Analysis and Antitumor Activity of Some Novel Quinolinones Derivatives: DFT Approach

Theoretical Calculations and Molecular Design of Novel Quinoline Derivatives as Antibacterial Drugs

Theoretical Study for Isomerization of Some 2´-Hydroxychalcone Derivative by Using DFT Calculation