Please use this identifier to cite or link to this item:
http://repositorio.ufla.br/jspui/handle/1/30446| Title: | Quantitative structure-activity relationship studies for potential rho-associated protein kinase inhibitors |
| Issue Date: | 2016 |
| Publisher: | Hindawi |
| Citation: | GAJO, G. C. et al. Quantitative structure-activity relationship studies for potential rho-associated protein kinase inhibitors. Journal of Chemistry, [S.l.], [2016?]. |
| Abstract: | A series of pyridylthiazole derivatives developed by Lawrence et al. as Rho-associated protein kinase inhibitors were subjected to four-dimensional quantitative structure-activity relationship (4D-QSAR) analysis. The models were generated applying genetic algorithm (GA) optimization combined with partial least squares (PLS) regression. The best model presented validation values of , , , , , , and . Furthermore, analyzing the descriptors it was possible to propose new compounds that predicted higher inhibitory concentration values than the most active compound of the series. |
| URI: | http://repositorio.ufla.br/jspui/handle/1/30446 |
| Appears in Collections: | DQI - Artigos publicados em periódicos |
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| File | Description | Size | Format | |
|---|---|---|---|---|
| ARTIGO_Quantitative structure-activity relationship studies for potential rho-associated protein kinase .pdf | 1,87 MB | Adobe PDF | View/Open |
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