openmolecules.org

 
Home » DataWarrior » Functionality » Splitting reactants column
Splitting reactants column [message #1972] Fri, 28 July 2023 13:33 Go to previous message
jeusamio is currently offline  jeusamio
Messages: 5
Registered: July 2023
Location: University of Barcelona
Junior Member
Hi,

I'm working through a file of reactions with two or three reactants and one to four products. I have found about the Extract reactants functionality but it groups them into a single cell with several structures. Since all my reactants contain at least an aldehyde and an alkene/alkyne, I was thinking if there is an option to copy the reactants and keep only the individual molecules that match a given substructure (like a CHO, for example).
Is there a way to do this?

Thank you very much.

Javier
 
Read Message
Read Message
Read Message
Read Message
Read Message
Previous Topic: Tab delimited txt / open special
Next Topic: unable to create new filters
Goto Forum:
  


Current Time: Fri Nov 22 10:30:01 CET 2024

Total time taken to generate the page: 0.03904 seconds