CDK Atom Numbering

Community Extensions
1

Hello,

I have set CDK atom numbering type as “canonical” by using File → Preferences → KNIME → Chemistry → CDK

I am wondering how is this numbering decided? What is the logic behind it?

Thanks
Heather

1 Like
2

Hi Heather,

I moved your question to the Community Extension -> CDK category of our forum.
Hopefully now someone from the CDK experts can see it better :slight_smile:

Best,
Martyna

3

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