The ATOM Modeling PipeLine (AMPL) is an open-source, modular, extensible software pipeline for building and sharing models to advance in silico drug discovery.
When plot_pred_vs_actual is called for a multitask model with NaNs for some of the task/compound combinations, the NaN values get plotted as a vertical column of points with X coordinate equal to the average actual value. They should be excluded from the plot entirely.
When plot_pred_vs_actual is called for a multitask model with NaNs for some of the task/compound combinations, the NaN values get plotted as a vertical column of points with X coordinate equal to the average actual value. They should be excluded from the plot entirely.