2D, 3D-QSAR and molecular docking of 4 (1H)-quinolones analogues with antimalarial activities
TPJ Villalobos, RG Ibarra, JJM Acosta - Journal of Molecular Graphics and …, 2013 - Elsevier
Cytochrome bc 1 has become a major focus as a molecular target in malaria parasites,
which are the most important vector-borne infectious disease in the world. The inhibition of
cytochrome bc 1 blocks the mitochondrial respiratory chain and the consequent arrest of
pyrimidine biosynthesis, which is essential for parasite development. The authors developed
a theoretical study of two-dimensional, three-dimensional quantitative structure–activity
relationships and a docking analysis of a series of 4 (1H)-quinolones acting as cytochrome …
which are the most important vector-borne infectious disease in the world. The inhibition of
cytochrome bc 1 blocks the mitochondrial respiratory chain and the consequent arrest of
pyrimidine biosynthesis, which is essential for parasite development. The authors developed
a theoretical study of two-dimensional, three-dimensional quantitative structure–activity
relationships and a docking analysis of a series of 4 (1H)-quinolones acting as cytochrome …
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