openmolecules.org Forum: Cheminformatics

Home » DataWarrior » Cheminformatics » Free Wilson Analysis

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

Free Wilson Analysis [message #1873]

Fri, 17 March 2023 17:44

amorrison
Messages: 38
Registered: March 2016

Member

Hi Thomas,

I was wondering if you think it would possible to do a Free-Wilson analysis within Datawarrior? Not necessarily a feature you might want to incorporate but if you think it would be achievable and could give me some hints I'd much appreciate it.

I appreciate there are ML models already available in DW, but as a medicinal chemist it's much easier for me to relate to the Free-Wilson models and I've used them successfully in the past. I do have other tools that I can use for this but being able to do it in DW would be marvellous.

Thanks,

Angus

Report message to a moderator

[Message index]

		Free Wilson Analysis By: amorrison on Fri, 17 March 2023 17:44
		Re: Free Wilson Analysis By: thomas on Sat, 18 March 2023 18:25
		Re: Free Wilson Analysis By: amorrison on Mon, 20 March 2023 08:41

Previous Topic:	Displaying change in r value from a selected sample of a dataset
Next Topic:	peediction missing values- descriptors

Goto Forum:

-=] Back to Top [=-

[ Syndicate this forum (XML) ] [

] [

]

Current Time: Sat Apr 05 17:28:01 CEST 2025

Total time taken to generate the page: 0.04110 seconds