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AutoDock4 and AutoDockTools4: Automated Docking with Selective Receptor Flexibility
We describe the testing and release of AutoDock4 and the accompanying graphical user interface AutoDockTools. AutoDock4 incorporates limited flexibility in the receptor. Several tests are reported here, including a redocking experiment with 188 diverse ligand-protein complexes and a cross-docking ex...
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| 主要な著者: | , , , , , , |
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| フォーマット: | Artigo |
| 言語: | Inglês |
| 出版事項: |
2009
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| 主題: | |
| オンライン･アクセス: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2760638/ https://ncbi.nlm.nih.gov/pubmed/19399780 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/jcc.21256 |
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