Flexible flexible ensemble docking protocol for screening HIV-1 protease inhibitors
Despite significant advances in computational chemistry, incorporation of protein flexibility remains to be a challenge. Recent approaches to predict binding pose with flexible receptors is limited by its computationally expensive models. Hence, it is important to find new methods to treat protein m...
| Main Authors: | , , |
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| Other Authors: | |
| Format: | Thesis |
| Language: | English |
| Subjects: |