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usecasestrbased [2013/10/09 20:05] rkissusecasestrbased [2013/10/10 16:11] flack
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 4. Try to set different property ranges in the **"Basic property filter"** step. Click on **"+ ADD CONDITION"** to add another **"Condition"**, and click on the **"X"** button next to a **"Condition"** to remove it. 4. Try to set different property ranges in the **"Basic property filter"** step. Click on **"+ ADD CONDITION"** to add another **"Condition"**, and click on the **"X"** button next to a **"Condition"** to remove it.
  
-5. Set the target for the **"Docking (Vina)"** workflow step. You can upload a [[http://en.wikipedia.org/wiki/Protein_Data_Bank_(file_format)|PDB]] file (3D structural data for your target) or search by keyword and select from ~10,000 prepared target structures.+5. Set the target for the **[[dockingvina|"Docking (Vina)"]]** workflow step. You can upload a [[http://en.wikipedia.org/wiki/Protein_Data_Bank_(file_format)|PDB]] file (3D structural data for your target) or search by keyword and select from ~10,000 prepared target structures.
  
 6. You can also add new workflow steps by clicking on the **"ADD WORKFLOW STEP"** button on the right at the end of the workflow. Detailed description of the available workflow steps can be found **[[tools|HERE]]**. 6. You can also add new workflow steps by clicking on the **"ADD WORKFLOW STEP"** button on the right at the end of the workflow. Detailed description of the available workflow steps can be found **[[tools|HERE]]**.
  
-7. After finalizing your workflow, you can set the **"Name"** and **"Description"** of the output collection and the **"Maximum hits"**. If you don't want to limit the number of hits in the output, you can delete the number from this field. Note that the maximum number of molecules in a single collection is limited and it depends on your **[[http://mcule.com/pricing|Price Plan]]**..+7. After finalizing your workflow, you can set the **"Name"** and **"Description"** of the output collection and the **"Maximum hits"**. If you don't want to limit the number of hits in the output, you can delete the number from this field. Note that the maximum number of molecules in a single collection is limited and it depends on your **[[https://mcule.com/pricing/|Price Plan]]**..
  
 8. Click on **"RUN"** 8. Click on **"RUN"**
usecasestrbased.txt · Last modified: 2014/01/01 15:26 by flack