Complementary Quantitative Structure–Activity Relationship Models for the Antitrypanosomal Activity of Sesquiterpene Lactones

Three complementary quantitative structure–activity relationship (QSAR) methodologies, namely, regression modeling based on (i) “classical” molecular descriptors, (ii) 3D pharmacophore features, and (iii) 2D molecular holograms (HQSAR) were employed on the antitrypanosomal activity of sesquiterpene...

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Bibliografiska uppgifter
I publikationen:Int J Mol Sci
Huvudupphovsmän: Kimani, Njogu M., Matasyoh, Josphat C., Kaiser, Marcel, Nogueira, Mauro S., Trossini, Gustavo H. G., Schmidt, Thomas J.
Materialtyp: Artigo
Språk:Inglês
Publicerad: MDPI 2018
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Article
Länkar:https://ncbi.nlm.nih.gov/pmc/articles/PMC6321053/
https://ncbi.nlm.nih.gov/pubmed/30467296
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms19123721
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