Abstract Cyclooxygenase 2 (COX-2) participates in the inflammation process by converting
arachidonic acid into prostaglandin G2 which increases inflammation, pain and fever. COX …

This work presents a multiscale theoretical investigation into the potential of quinoxaline
derivatives (Q1–Q6) as corrosion inhibitors for various metals (Fe (110), Cu (111), and Al …

Diabetes mellitus continues to be a major health concern for the global population.
Targeting visfatin has been identified as a possible channel to manage the disease …

About 30% of malignant tumors include KRAS mutations, which are frequently required for
the development and maintenance of malignancies. KRAS is now a top-priority cancer target …

Amino-1, 3-dimethyluracil (1) has two electron donating centres (NH 2 and C-5) and its
chemical reactivity was investigated towards a variety of electrophilic reagents hoping to …

This study employs density functional theory (DFT) approach with Gaussian-09 W and
Gauss view-05 programs, utilizing the DFT/B3LYP level of theory (method)/6–31 (d, p) basis …

Calculations using density functional theory (DFT) and Monte Carlo methods were
performed on 2-methylbenzimidazole, 2-mercaptobenzimidazole, 2-aminobenzimidazole …

Abstract In this work, 3-(3-(4-Chlorophenyl)-1-phenyl-1H-pyrazol-4-yl)-5-ethoxy-4H-1, 2, 4-
triazole compound has been synthesized and experimentally (FT-IR and 1H and 13Csingle …

Diabetes mellitus is a disease that continues to pose serious health challenges to the
world's population. Protein tyrosine phosphatase 1B (PTP1B) is an enzyme that plays …

Malaria is among the top-ranked parasitic diseases that pose a threat to the existence of the
human race. This study evaluated the antimalarial effect of the rhizome of Zingiber officinale …