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Decompose R-Groups [message #2346]

Wed, 06 November 2024 13:02

amorrison
Messages: 38
Registered: March 2016

Member

Hi,

I use the decompose R-groups for SAR analysis frequently. Usually DataWarrior does a great job across multiple scaffolds of placing the R-groups in the correct place but in some cases I would like to specify what a particular substitution off the scaffold should be e.g. R1. I don't think this currently possible in the current version of DataWarrior, but would it be easy to implement?

Many thanks,
Angus

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[Message index]

		Decompose R-Groups By: amorrison on Wed, 06 November 2024 13:02
		Re: Decompose R-Groups By: thomas on Tue, 12 November 2024 19:07
		Re: Decompose R-Groups By: amorrison on Sun, 17 November 2024 08:34

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