openmolecules.org Forum: Functionality

Home » DataWarrior » Functionality » Duplicate Molecules

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

Re: Duplicate Molecules [message #801 is a reply to message #797]

Wed, 04 March 2020 21:18

sbembenek18
Messages: 63
Registered: April 2019

Member

I see what it is now. I have molecules where nitrogen might be considered a stereocenter. So, whereas the program that wrote the SDF considers that there are distinct stereoisomers, DW does not. I think this is consistent with the challenges of assessing this for these molecules.

Report message to a moderator

[Message index]

		Duplicate Molecules By: sbembenek18 on Mon, 02 March 2020 00:30
		Re: Duplicate Molecules By: thomas on Mon, 02 March 2020 18:46
		Re: Duplicate Molecules By: sbembenek18 on Wed, 04 March 2020 21:18

Previous Topic:	Hyperlinks
Next Topic:	New feature request: Autosave

Goto Forum:

-=] Back to Top [=-

[ Syndicate this forum (XML) ] [

] [

]

Current Time: Wed Sep 09 08:29:46 CEST 2026

Total time taken to generate the page: 0.00582 seconds