Evaluation of novel HIV-1 protease inhibitors with DRV-resistance by utilizing 3D-QSAR molecular docking and molecular dynamics simulation
| العنوان: | Evaluation of novel HIV-1 protease inhibitors with DRV-resistance by utilizing 3D-QSAR molecular docking and molecular dynamics simulation |
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| المؤلفون: | Yan-Jun Zhang, Lu Chen, Jie Xu, Hui-Fang Jiang, Yi-Ren Zhu, Zhong-Hua Wang, Fei Xiong |
| المصدر: | New Journal of Chemistry. 46:21885-21897 |
| بيانات النشر: | Royal Society of Chemistry (RSC), 2022. |
| سنة النشر: | 2022 |
| مصطلحات موضوعية: | Materials Chemistry, General Chemistry, Catalysis |
| الوصف: | Molecular dynamics simulations were performed to explore the interaction mode of DRV derivatives binding to target proteins and to identify new potential HIV-1 PR inhibitors with stronger activity. |
| تدمد: | 1369-9261 1144-0546 |
| URL الوصول: | https://explore.openaire.eu/search/publication?articleId=doi_________::89b53173ad0041e4a998e0c1c79f45f7 https://doi.org/10.1039/d2nj04492g |
| حقوق: | CLOSED |
| رقم الأكسشن: | edsair.doi...........89b53173ad0041e4a998e0c1c79f45f7 |
| قاعدة البيانات: | OpenAIRE |
| تدمد: | 13699261 11440546 |
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