openmolecules.org Forum: Functionality » exporting R groups of compounds

Search
Help
Members
Register
Login
Home

Home » DataWarrior » Functionality » exporting R groups of compounds (exporting)

Show: Today's Messages :: Polls :: Message Navigator

exporting R groups of compounds [message #482]

Wed, 06 March 2019 16:00

jkulpiii
Messages: 1
Registered: March 2019

Junior Member

When I exported as a SDF file, the R groups or fragment data was lost. When I exported as txt file I did get these columns: Scaffold [idcode] R1 [idcode] R2 [idcode]

What file type is the idcode? I do not recognize it. I would like to convert it to smiles.

Thanks for the help

Report message to a moderator

[Message index]

		exporting R groups of compounds By: jkulpiii on Wed, 06 March 2019 16:00
		Re: exporting R groups of compounds By: thomas on Thu, 07 March 2019 18:08

Previous Topic:	Flexophores
Next Topic:	DWAR file format

Goto Forum:

-=] Back to Top [=-

[ Syndicate this forum (XML) ] [

] [

]

Current Time: Sat Oct 31 07:16:06 CET 2026

Total time taken to generate the page: 0.00580 seconds