public class MutagClassification extends Object
ShortestPathKernel
(operating on DirectedGraphRepresentations)
and the Weisfeiler-Lehman Subtree Kernel for Graphs. This last is performed applying an explicit mapping of the
graphs into the RKHS of the kernel. This mapping is operated by the WLSubtreeMapper
[1] Debnath, A.K. Lopez de Compadre, R.L., Debnath, G., Shusterman, A.J., and Hansch, C. (1991).
Structure-activity relationship of mutagenic aromatic and heteroaromatic nitro compounds.
Correlation with molecular orbital energies and hydrophobicity. J. Med. Chem. 34:786-797.Constructor and Description |
---|
MutagClassification() |
Copyright © 2018 Semantic Analytics Group @ Uniroma2. All rights reserved.