Protein-Ligand Blind Docking Using QuickVina-W With Inter-Process Spatio-Temporal Integration
“Virtual Screening” is a common step of in silico drug design, where researchers screen a large library of small molecules (ligands) for interesting hits, in a process known as “Docking”. However, docking is a computationally intensive and time-consuming process, usually restricted to small size bin...
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| Main Authors: | , , , |
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| 格式: | Article |
| 語言: | English |
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2018
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| 主題: | |
| 在線閱讀: | https://hdl.handle.net/10356/89044 http://hdl.handle.net/10220/44804 |
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| 機構: | Nanyang Technological University |
| 語言: | English |