Re: defining molecule clusters after similarity analysis [message #1579 is a reply to message #1534] |
Tue, 05 April 2022 15:03 |
thomas
Messages: 715 Registered: June 2014
|
Senior Member |
|
|
Hi Xènia,
you are not the first to ask for that. Thus, I have updated the similarity/activity-cliff-analysis to generate two more columns: a cluster number and the cluster member count. You can download the updated DataWarrior file (dev version) from the link in the fine-print that appears when clicking the 'read and understood' checkbox on the DataWarrior download page.
Hope this solves the issue for you,
Thomas
[Updated on: Tue, 05 April 2022 15:03] Report message to a moderator
|
|
|