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Fig. 3 | Journal of Cheminformatics

Fig. 3

From: MetaRF: attention-based random forest for reaction yield prediction with a few trails

Fig. 3

Example of nonlinear dimension reduction on the “Swiss roll” dataset. A Euclidean distance (dashed line) in the high-dimensional input space may not reflect the true low-dimensional geometry of the manifold (Solid line). B Using KS algorithm to select the most representative samples on the high-dimensional input space, samples in the central area (dashed square) will not be selected. C Using KS algorithm after the nonlinear dimension reduction, samples in the the central area (dashed square) will be selected

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