Bioisostere replacement

KNIME Hub
#1

Replaces functional groups of each input ligand with bioisosteres, generating all the single replacements. [32287] 24.1.1 See details in https://kni.me/w/wqgsYj8ZLeKHCl_q

This is a companion discussion topic for the original entry at https://kni.me/w/Vd01KRmE54dhlQur
#2

Hi there, I would be super interested to integrate bioisostere replacement in one of my python script. Does this tool exist in Python?
Thanks,
Alexis

#3