Comparing Iterations

You can compare iterations generated by an experiment after running it.


Before you begin: Create and run an experiment. For more information, see Creating and Running Experiments.
See Also
Opening Results
Viewing Convergence
Viewing Iterations
Viewing Iteration Data
Analyzing Results
Viewing Molecule Details
  1. From the home page, click Projects, Studies, and Experiments.
  2. Open a completed experiment, and then open the Iterations tab.
  3. Click .
  4. Choose the Iterations to graph.
  5. Choose the Properties for the X and Y axes.

    This opens a scatter plot of the selected properties of molecules in the chosen iterations. Use this view to see progress across iterations:

  6. Use the tools at the bottom of the graph to change the display.
    • Click to show or hide the key.
    • Click or to show and hide the graph line.
    • Click to show or hide the text.