Exploring QSAR for Antimalarial Activities and Drug Distribution within Blood of a Series of 4-Aminoquinoline Drugs Using Genetic-MLR
作者： Amir Najafi , Soheil Sobhanardakani , Mehdi Marjani
DOI: 10.1155/2013/560415
关键词:
摘要: Malaria has been one of the most significant public health problems for centuries. QSAR modeling antimalarial activity and blood-to-plasma concentration ratio Chloroquine a new series 4-aminoquinoline derivatives were developed using genetic algorithms with multiple linear regression (GA-MLR) method. We obtained two different models against Chloroquine-sensitive (3D7) Chloroquine-resistant (W2) strains Plasmodium falciparum good adjustment levels. Drug distribution in blood, defined as drug (), is related to molecular descriptors. Leave-many-out (LMO) Y-randomization methods confirmed models' robustness.
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