Rational Design of a Low-Data Regime of Pyrrole Antioxidants for Radical Scavenging Activities Using Quantum Chemical Descriptors and QSAR with the GA-MLR and ANN Concepts
A series of pyrrole derivatives and their antioxidant scavenging activities toward the superoxide anion (O<sub>2</sub><sup>•−</sup>), hydroxyl radical (<sup>•</sup>OH), and 1,1-diphenyl-2-picryl-hydrazyl (DPPH<sup>•</sup>) served as the training data sets of a quantitative structure–activity relatio...
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| Auteurs principaux: | , , , , , |
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| Format: | Artigo |
| Langue: | Inglês |
| Publié: |
MDPI AG
2023-02-01
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| Collection: | Molecules |
| Sujets: | |
| Accès en ligne: | https://www.mdpi.com/1420-3049/28/4/1596 |
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