Ranking microbial metabolomic and genomic links in the NPLinker framework using complementary scoring functions
Fig 3
Arrow diagram of the Input-Output Kernel Regression (IOKR) framework.
X denotes the space of MS2 spectra, is the space of metabolites, and
is the shared space of molecular fingerprints.
is the (learned) mapping from MS2 to fingerprints, while ϕ is the (exact) mapping from metabolites to molecular fingerprints.