Proguanil

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Application of molecular docking and PSO-SVR intelligent approaches in antimalarial activity prediction of enantiomeric cycloguanil analogues.

SAR and QSAR in environmental research Nov 1, 2018
A series of antifolate compounds, i.e. 1-(4-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine, or cycloguanil analogues, have shown effective inhibiting properties against Plasmodium falciparum dihydrofolate reductase (PfDHFR). In this work, the ...
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Machine Learning Algorithms Reproducibility of Results Molecular Docking Simulation Protein Binding Plasmodium falciparum Molecular Structure Antimalarials Enzyme Inhibitors Quantitative Structure-Activity Relationship Stereoisomerism Folic Acid Antagonists Substrate Specificity Triazines Proguanil Tetrahydrofolate Dehydrogenase
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