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. 2012 Mar 17;4:7. doi: 10.1186/1758-2946-4-7

Figure 4.

Figure 4

Wizard Step 3: Extract features. Users can select features that are precomputed in the dataset or can be computed by CheS-Mapper. Compounds with similar feature values are likely to be clustered together and are embedded closer to each other in 3D space.