openmolecules.org Forum: Bug Reports » Unable to diaplay zwitterion structure correctly in both + and

Home » DataWarrior » Bug Reports » Unable to diaplay zwitterion structure correctly in both + and - sperately (Display structure issues)

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

Unable to diaplay zwitterion structure correctly in both + and - sperately [message #1910]

Fri, 02 June 2023 09:35

SallyS
Messages: 1
Registered: June 2023

Junior Member

Hi,

I was writing this message to report a display isuue for zwitterion structures.

For instance,

O=C([O-])c1cc(NS(=O)(=O)c2ccccc2Cl)cnc1N1CCC[C@H](C[NH+]2CCC C2)C1
This structure contains both N+ and O-, and the net charge is 0.

However this structure was displayed as attachments 'strcuturedisplay.jpg', /forum/index.php?t=getfile&id=706&private=0

/forum/index.php?t=getfile&id=706&private=0

unlike what it could be correctly in attachment 'strcuturedisplay.jpg' /forum/index.php?t=getfile&id=705&private=0

I am not sure its a bug or I could set any function to show the strcuture correctly.
Thank you for your time and I am looking forward to hearing from you soon.

Best regards,
Sally

Attachment: strcuture_correct.jpg
(Size: 20.05KB, Downloaded 684 times)
Attachment: strcuturedisplay.jpg
(Size: 28.18KB, Downloaded 614 times)

Report message to a moderator

[Message index]

		Unable to diaplay zwitterion structure correctly in both + and - sperately By: SallyS on Fri, 02 June 2023 09:35
		Re: Unable to diaplay zwitterion structure correctly in both + and - sperately By: thomas on Sun, 04 June 2023 21:14

Previous Topic:	add calculated values
Next Topic:	conformer generation sometimes skips isomer generation

Goto Forum:

-=] Back to Top [=-

[ Syndicate this forum (XML) ] [

] [

]

Current Time: Thu Feb 19 04:32:15 CET 2026

Total time taken to generate the page: 0.00739 seconds