QSAR, DFT studies, docking molecular and simulation dynamic molecular of 2-styrylquinoline derivatives through their anticancer activity
In this study, a 2D-QSAR (quantitative structure–activity relationship) was performed on 54 new 2-Styrylquinoline derivatives as anticancer substances capable of inhibiting the p53 protein in the cell HCT116++. The 54 2-Styrylquinoline derivatives was calculated applying DFT 6-31G basis to calculate...
| Main Authors: | , , , , , , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Elsevier
2023-11-01
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| Series: | Journal of Saudi Chemical Society |
| Subjects: | |
| Online Access: | http://www.sciencedirect.com/science/article/pii/S1319610323001321 |