Published Workflows | ana88 | Cdk-McQSAR

Galaxy Workflow ' Cdk-McQSAR'

Annotation: model building and activity prediction

StepAnnotation
Step 1: Input dataset
select at runtime
Step 2: Input dataset
select at runtime
Step 3: Input dataset
select at runtime
Step 4: CDKDescriptorCalculation
Output dataset 'output' from step 1
Step 5: CDKDescriptorCalculation
Output dataset 'output' from step 3
Step 6: Paste
Output dataset 'output' from step 4
Output dataset 'output' from step 2
Tab
Step 7: Predict Activity Using McQSAR
Output dataset 'output' from step 5
select at runtime
Step 8: Build QSAR Model
Output dataset 'out_file1' from step 6
Activity