API Reference
chemicalchecker
chemicalchecker.core
chemicalchecker.database
chemicalchecker.tool
chemicalchecker.tool.adanet
chemicalchecker.tool.hotnet
chemicalchecker.tool.node2vec
chemicalchecker.tool.siamese
chemicalchecker.tool.smilespred
chemicalchecker.tool.targetmate
chemicalchecker.util
Contents:
Chemical Checker Manifesto
Datasets
Signaturization
chemicalchecker
chemicalchecker
chemicalchecker.tool
chemicalchecker.tool.targetmate
chemicalchecker.tool.targetmate.io
chemicalchecker.tool.targetmate.io.MoleculeData
View page source
chemicalchecker.tool.targetmate.io.MoleculeData
class
MoleculeData
(
data
,
sort
)
[source]
Bases:
object
A simple molecule data container
Initialize
Methods