Structure standardisation for molecules

This workflow uses RDKit to standardise the input structures. The user can use SDF or SMILES structures and standardise them with various options. Please note that the workflow requires python > = 3.6 with the RDKit and pandas package. For more information pelase also look at out github repository.


This is a companion discussion topic for the original entry at https://kni.me/w/auOFJsQKZXJmSc_9