| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5450035 | Physica E: Low-dimensional Systems and Nanostructures | 2017 | 39 Pages |
Abstract
For the aim of finding any correlation and predicting the activity of 49 fullerene derivatives, a number of 512 descriptors were calculated and three QSAR models were developed against HIV-protease activity. The van der Waals volumes and ionization/electronegativity features mainly have an effective role in predicting activity of fullerene compounds.281
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Related Topics
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Materials Science
Electronic, Optical and Magnetic Materials
Authors
Abolfazl Barzegar, Somaye Jafari Mousavi, Hossein Hamidi, Mehdi Sadeghi,