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https://scidar.kg.ac.rs/handle/123456789/10802| Title: | Antioxidative capacity of evernic acid and its interactions with TDP1 |
| Authors: | Đorović Jovanović, Jelena     Jeremić O. Manojlovic, Nedeljko Milenkovic, Dejan Marković, Zoran |
| Issue Date: | 2019 |
| Abstract: | © 2019 IEEE. The antioxidant activity of evernic acid acid was studied in the absence and in the present of free radical species. This in silico study was performed in water solvent, to mimic polar environment. The reaction enthalpies for reactions of evernic acid with three different free radicals are presented. The molecular docking study was performed in order to estimate the inhibition activity of investigated compound toward Human tyrosine-DNA phosphodiesterase (TDP1). The obtained results indicate that a numerous interactions determine the activity towards investigated protein. In addition, molecular dynamic simulation were done. |
| URI: | https://scidar.kg.ac.rs/handle/123456789/10802 |
| Type: | conferenceObject |
| DOI: | 10.1109/BIBE.2019.00019 |
| SCOPUS: | 2-s2.0-85078574193 |
| Appears in Collections: | Faculty of Medical Sciences, Kragujevac Institute for Information Technologies, Kragujevac |
 | Page views(s)816 | Downloads(s)23 |
Files in This Item:
| File | Description | Size | Format | |
|---|---|---|---|---|
| PaperMissing.pdf Restricted Access | 29.86 kB | Adobe PDF |  View/Open |
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