openmolecules.org

 
Home » DataWarrior » Functionality » Similarity analysis using "find similar compounds..." - slow analysis of libraries (Similarity analysis)
Re: Similarity analysis using "find similar compounds..." - slow analysis of libraries [message #1144 is a reply to message #1141] Sun, 29 November 2020 15:07 Go to previous messageGo to previous message
SM2020
Messages: 13
Registered: June 2020
Location: UK
Junior Member
That great Thomas! Thanks very much.

I've installed and it seems to be working well, including using other descriptors as the basis for the similarity comparison.
I played around with workflows in Knime to achieve similar results but now that this is incorporated into the DW development version, it so much more straightforward(!Wink. Brilliant.

Thanks again.
 
Read Message
Read Message
Read Message
Read Message
Read Message
Read Message
Read Message
Read Message
Read Message
Read Message
Previous Topic: Confidentiality of compound structures
Next Topic: reaction enumeration reagent connection
Goto Forum:
  


Current Time: Fri Nov 22 15:33:53 CET 2024

Total time taken to generate the page: 0.04152 seconds