openmolecules.org Forum: Functionality » bar graph Murcko Skeleton and count

Home » DataWarrior » Functionality » bar graph Murcko Skeleton and count (file size issue perhaps)

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

bar graph Murcko Skeleton and count [message #1751]

Thu, 13 October 2022 21:46

khom
Messages: 9
Registered: April 2018

Junior Member

Dear fellow users,
I am trying to plot a bar graph with the Murcko Ring systems (Chemistry --> Analyze Scaffold --> Murcko Skeleton) on the x-axis and with the number of molecules belonging to a particular ring system as the value for the vertical bars. The scheme I used with a file of 97 entries worked, but failed for a file with 2000 entries. The error message was: "A bar chart is not shown because an axis is assigned to a column that does not contain categories". My troubleshooting attempt of excluding the entries without a Murcko Skeleton did not succeed; however, reducing the number of entries to about 200 worked. Is this a (my) computer issue ? Thank you.

Attachment: Screenshot_2022-10-13_15-38-53.png
(Size: 43.63KB, Downloaded 237 times)

Report message to a moderator

[Message index]

		bar graph Murcko Skeleton and count By: khom on Thu, 13 October 2022 21:46
		Re: bar graph Murcko Skeleton and count By: thomas on Fri, 14 October 2022 19:42
		Re: bar graph Murcko Skeleton and count By: khom on Wed, 19 October 2022 16:56

Previous Topic:	Feature Request
Next Topic:	Generate tautomers

Goto Forum:

-=] Back to Top [=-

[ Syndicate this forum (XML) ] [

] [

]

Current Time: Mon Apr 14 13:33:56 CEST 2025

Total time taken to generate the page: 0.03107 seconds