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Re: Lilly Medchem Rules [message #1077 is a reply to message #889]

Tue, 15 September 2020 16:29

evehom
Messages: 10
Registered: May 2015
Location: Stockholm, Sweden

Junior Member

Hi Thomas

I think the REOS rules by Pat Walters & colleagues from Vertex ( https://www.sciencedirect.com/science/article/abs/pii/S13596 4469701163X?via%3Dihub Wink

are substantially easier to implement (but also well-established) since they were written as SMARTS and there are 'only' 117. I can provide you with the list if you are interested.

Cheers/Evert

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[Message index]

		Lilly Medchem Rules By: mvamos on Thu, 16 April 2020 20:50
		Re: Lilly Medchem Rules By: nbehrnd on Thu, 23 April 2020 19:29
		Re: Lilly Medchem Rules By: mvamos on Tue, 28 April 2020 00:25
		Re: Lilly Medchem Rules By: IanWatson on Sun, 03 May 2020 21:21
		Re: Lilly Medchem Rules By: thomas on Fri, 08 May 2020 18:02
		Re: Lilly Medchem Rules By: evehom on Tue, 15 September 2020 16:29

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