Hi Rdkit forum,

 

Easy question, perhaps difficult to answer…  

 

I’ve been reading a lot of support messages, many a very old about how to get 
warnings (only visible at the cmd line) to be send to files.

I can get error messages sent, but not warnings.

 

The type I’m trying to capture are – which I can see when I run code at the cmd 
line, but not in jupyter-notebook.

“charges were rearranged”

“Omitted undefined stereo”

 

Ideally I’d like to run the code in jupyter-notebook and also at the cmd line 
with python script.py etc  and get the warnings into a file.

 

Can you provide me with a simple example as to how to do this?

 

Thanks,

mike

 

 



 

Dr Mike Mazanetz, FRSC

Director

 

Honorary Lecturer

School of Natural and Computing Sciences

University of Aberdeen

 

+44 (0) 141 533 0930

+44 (0) 7780 672509

mi...@novadatasolutions.co.uk

www.novadatasolutions.co.uk

skype michael.mazanetz

 

NovaData Solutions Ltd.

PO Box 639

Abingdon-on-Thames

Oxfordshire

OX14 9JD

United Kingdom

 
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