usecaseligbased
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usecaseligbased [2013/10/09 20:12] – [Ligand-based virtual screening] rkiss | usecaseligbased [2013/10/11 08:39] – rkiss | ||
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Ligand-based virtual screening does not utilize the 3D structure of the target when searching for new hits. Instead, it is based on the structure of a reference ligand (endogenous ligand, known inhibitor, etc.) that binds to a target and/or exhibits some beneficial effect. In ligand-based virtual screening, compounds are typically ranked based on the similarity to the reference ligand (query). | Ligand-based virtual screening does not utilize the 3D structure of the target when searching for new hits. Instead, it is based on the structure of a reference ligand (endogenous ligand, known inhibitor, etc.) that binds to a target and/or exhibits some beneficial effect. In ligand-based virtual screening, compounds are typically ranked based on the similarity to the reference ligand (query). | ||
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6. You can also add new workflow steps by clicking on the **"ADD WORKFLOW STEP" | 6. You can also add new workflow steps by clicking on the **"ADD WORKFLOW STEP" | ||
- | 7. After finalizing your workflow, you can set the **" | + | 7. After finalizing your workflow, you can set the **" |
8. Click on **" | 8. Click on **" |
usecaseligbased.txt · Last modified: 2014/01/01 15:50 by flack