Knime linear regression with molecular fingerprints and descriptors

[Alice_Krebs]

Hi

We had that topic here in the forum just a few days ago:

chemical fingerprints in a regression

Hi, I am running a linear regression for several chemical compounds. I have included the RDkit chemical descriptors. I am looking for a way to incorporate chemical fingerprints of the molecules into this linear regression. I was just wondering if anyone had some advice on this. Thank you in advance!!

Maybe that discussion already answers some of your questions. Please let me know if there should be any questions left

Best
Alice