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Normalized ratios of principal moments of inertia analysis. Two principle component magnitude ratios are plotted, npr1 (x-axis) and npr2 (y-axis) (see Methods). Rod-shaped molecules appear in top left of graph, disc-shaped in the bottom middle, and sphere in the top right The heatmaps are colored by the number of molecules in each of 500,000 pixels. A) ZINC in-stock Ro4 B) MLSMR C) SMDC. D) ZINC Ro4 make-on-demand.
