openmolecules.org Forum: Bug Reports » Aromaticity perception

Home » DataWarrior » Bug Reports » Aromaticity perception (Issues with kekulising aromatic structures)

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

Re: Aromaticity perception [message #968 is a reply to message #967]

Fri, 26 June 2020 10:13

nbehrnd
Messages: 234
Registered: June 2019

Senior Member

Hi Simon,

may you add from which software / file format you import into DW to observe these issues and share a typical minimal input/output file? For now, it reads related to the (intermediate) representation of 2-pyridone with SMILES either as lactam C1=CC=CNC(=O)1, or lactim Oc1ccccn1.

Norwid

Report message to a moderator

[Message index]

		Aromaticity perception By: richards99 on Thu, 25 June 2020 22:38
		Re: Aromaticity perception By: nbehrnd on Fri, 26 June 2020 10:13
		Re: Aromaticity perception By: richards99 on Sun, 28 June 2020 00:09
		Re: Aromaticity perception By: richards99 on Sun, 28 June 2020 00:14
		Re: Aromaticity perception By: nbehrnd on Sun, 28 June 2020 23:57
		Re: Aromaticity perception By: thomas on Thu, 02 July 2020 14:41

Previous Topic:	Rounding behavior changed?
Next Topic:	Molecule Displayed Incorrectly

Goto Forum:

-=] Back to Top [=-

[ Syndicate this forum (XML) ] [

] [

]

Current Time: Wed Aug 20 00:36:26 CEST 2025

Total time taken to generate the page: 0.08504 seconds