QSAR CSV to Weka Regression Dataset

Created: 2011-07-21 19:37:38

Download Workflow

This workflow converts the molecular descriptor data from a CSV file to a Weka XRFF file. The workflow merges the retention time values from IN IDRT CSV with the molecular descriptor values from IN QSAR CSV to create a valid Weka regression set.

Preview

Download as scalable diagram (SVG)

Run

Run this Workflow in the Taverna Workbench...

Option 1:

Copy and paste this link into File > 'Open workflow location...'
http://myexperiment.org/workflows/2272/download?version=1
[ More Info Expand ]

Workflow Components

Authors (0)

Titles (0)

Descriptions (0)

Dependencies (0)

Inputs (3)

Name	Description
IN_QSAR_CSV
IN_IDRT_CSV
OUT_XRFF

Processors (5)

Name	Type	Description
XRFF_File_Writer	taverna
CSV_File_Reader	taverna
CSV_File_Reader_2	taverna
Create_Weka_Dataset_From_CSV	taverna
Create_Weka_Regression_Dataset	taverna

Beanshells (0)

Outputs (0)

Datalinks (7)

Source	Sink
Create_Weka_Regression_Dataset:Weka Regression Dataset	XRFF_File_Writer:Weka Datasets
OUT_XRFF	XRFF_File_Writer:File
IN_QSAR_CSV	CSV_File_Reader:File
IN_IDRT_CSV	CSV_File_Reader_2:File
CSV_File_Reader:CSV String	Create_Weka_Dataset_From_CSV:CSV
CSV_File_Reader_2:CSV String	Create_Weka_Regression_Dataset:ID Class CSV
Create_Weka_Dataset_From_CSV:Weka Dataset	Create_Weka_Regression_Dataset:Weka Dataset