| read.kcf | |
| buildDocuments | build molecule documents for do embedding |
| molecular_graph | parse the smiles structure string as molecular network graph |
| embedded.graph2vector | make the molecular graph embedding to vector |
| {spectral_simulator} | R# Documentation |
require(mzkit);
{$desc_comments}
imports "spectral_simulator" from "mzDIA";
| read.kcf | |
| buildDocuments | build molecule documents for do embedding |
| molecular_graph | parse the smiles structure string as molecular network graph |
| embedded.graph2vector | make the molecular graph embedding to vector |