The focus of this chapter has been to describe and analyze prodrug approach using
quantum molecular orbital methods toward enhancing bioavailability of the antimalarial …

Density Functional Theory (DFT) and ab initio calculation results for the proton transfer
reaction in Kirby's enzyme models 1‐6 reveal that the reaction rate is largely dependent on …

A molecular modeling study was applied to a data set of 21 analogues (2a–2u) of
amodiaquine (2) exhibiting remarkable in vitro activity against the chloroquine-and …

Lapachol is an abundant prenyl naphthoquinone occurring in Brazilian Bignoniaceae that
was clinically used, in former times, as an antimalarial drug, despite its moderate effect …

An integrated computational approach has been applied to a series of quinazoline
derivatives to identify a potentially efficacious agent for malarial therapy. The best QSAR …

Malaria persists as the most infectious vector-borne disease in the world. The inhibition of
the mitochondrial respiratory chain enzyme cytochrome bc1 has become the major focus as …

Malaria is the most important parasitic disease in humans, with transmission occurring in
over 100 countries with a population of three billion people. It is caused by protozoan …

Malaria has been known as one of the major causes of morbidity and mortality on a large
scale in tropical countries until now. In the past decades, many scientific groups have …

Due to an undecided target and the prescription of chiral-aminoquinolines (chloroquine,
primaquine and quinacrine) in the racemic form, the mechanism of action as well as the …

With the aim of controlling drug resistant Plasmodium falciparum, a computational attempt of
designing novel adduct antimalarial drugs through the molecular docking method of …