openmolecules.org

 
Home » DataWarrior » Functionality » Comparing Structure Files (proble to use the "Find similar compound in other file" tool)
Re: Comparing Structure Files [message #1535 is a reply to message #1479] Tue, 08 March 2022 15:37 Go to previous messageGo to previous message
biolive31!! is currently offline  biolive31!!
Messages: 5
Registered: January 2022
Junior Member
Dear Norwid,
Thank you to keep inform about this problem. Where the development version is downable ?
In addition in the version I used there is an other bugg in the fine similarity function when you slect Structure[FragFp] tools.
When you are using this tool to find similar compound in an other SDF file it work well only when you are not selecting colomuns to be copied into the file. When you select a colummn to copy into the file the similarity tool doesn't work.

Thank you for your help

Olivier
 
Read Message
Read Message
Read Message
Read Message
Read Message
Read Message
Read Message
Read Message
Read Message
Read Message
Previous Topic: Video tutorial on using Datawarrior to undertake QSAR predictions
Next Topic: search for conformers, empty column «minimization error»
Goto Forum:
  


Current Time: Fri Nov 22 17:11:21 CET 2024

Total time taken to generate the page: 0.04042 seconds