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Labs

This category contains 6 nodes.

2D Sketcher 

Opens 2D Sketcher

DeepAutoQSAR Build 

Build a new QSAR model using deepchem methods.

DeepAutoQSAR Predict 

Load an exiting QSAR model to make predictions using deepchem methods.

Job Monitor 

Opens the Job Monitor python panel

LiveDesign Input 

LiveDesign Input

Protein Preparation Workflow 

Set up and run the protein preparation.