openmolecules.org

 
Home » DataWarrior » Cheminformatics » sp3 count
Re: sp3 count [message #1381 is a reply to message #1369] Fri, 20 August 2021 12:05 Go to previous message
thomas is currently offline  thomas
Messages: 646
Registered: June 2014
Senior Member
I just deployed an update with 'sp3-Carbon Fraction', which is the count of sp3 carbons devided by all carbons as proposed in the 'Escape from flatland' paper.
 
Read Message
Read Message
Read Message
Read Message
Previous Topic: Mean value in category function
Next Topic: Integration with KNIME or Python
Goto Forum:
  


Current Time: Thu Mar 28 11:03:15 CET 2024

Total time taken to generate the page: 0.08268 seconds