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. 2015 Jan 23;71(Pt 2):352–356. doi: 10.1107/S1399004714025875

Table 1. The five command-line applications in the Data Exploration Toolkit .

cluster.unit_cell Uses hierarchical clustering to visualize and cluster the unit cells output from the integration step.
cluster.visualize_orientations Visualizes the orientational distribution of the real-space crystal axes, revealing any bias that may be present. Laboratory-frame orientations of the a, b and c axes are projected onto a globe, with a color map added to make the distribution more clear.
cluster.intensity_statistics Aggregates data of partial intensities over all images. Generates a scatter plot of slope and intercept for all images, and histograms of gradient and standard errors on the fits. Also creates a super-plot of all of the partial log intensities versus sin2()/2.
cluster.individual_frame_intensity Generates a plot of log(I partial) versus sin2()/2 for each image. Also plots a rolling average and a linear fit to the data: a ‘pseudo-Wilson’ plot.
cluster.42 Convenience utility to provide an aggregate of the unit cell, orientations and intensity histograms in a single frame with a single command.