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jvalegre / robert

Automated machine learning protocols that start from CSV databases of descriptors or SMILES and produce publication-quality results in Chemistry studies with only one command line.
MIT License
33 stars 5 forks source link

Include outlier detector #4

Closed jvalegre closed 1 year ago

jvalegre commented 2 years ago

Print the names of the outliers as you did in the Ir paper