Articles with "qsar docking" as a keyword



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MIA-QSAR and docking studies of recent HPPD inhibitors.

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Published in 2023 at "Journal of the science of food and agriculture"

DOI: 10.1002/jsfa.12608

Abstract: BACKGROUND Mesotrione is a triketone widely used as an inhibitor of the hydroxyphenylpyruvate deoxygenase (HPPD) enzyme. However, new agrochemicals should be continuously developed to tackle the problem of herbicide resistance. Two sets of mesotrione analogs… read more here.

Keywords: mia qsar; hppd inhibitors; qsar docking; docking studies ... See more keywords
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3D-QSAR, docking and ADMET properties of aurone analogues as antimalarial agents

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Published in 2020 at "Heliyon"

DOI: 10.1016/j.heliyon.2020.e03580

Abstract: The development of multi-resistant strains of plasmodium parasite has become a global problem, therefore, the discovery of new antimalarial agents is the only available solution. In order to improve and propose new compounds with antimalarial… read more here.

Keywords: qsar docking; docking admet; admet properties; antimalarial agents ... See more keywords