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Re: Why is clustering limited up to 10000 molecules? [message #255 is a reply to message #252]

Thu, 30 March 2017 20:35

thomas
Messages: 729
Registered: June 2014

Senior Member

Hi Dataviz,

I have lifted the limit from 10.000 to 100.000 structures, but display a warning above 20.000 compounds. Nevertheless, clustering of significantly more structures than 20.000 will require a Linux or Macintosh computer, where it is easy to increase the memory maximum that DataWarrior is allowed to use. The change will be available with the next update.

Regards, Thomas

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[Message index]

		Why is clustering limited up to 10000 molecules? By: Nastasia on Wed, 22 July 2015 16:37
		Re: Why is clustering limited up to 10000 molecules? By: thomas on Thu, 23 July 2015 21:40
		Re: Why is clustering limited up to 10000 molecules? By: avkitex on Sun, 28 February 2016 19:03
		Re: Why is clustering limited up to 10000 molecules? By: thomas on Thu, 03 March 2016 21:49
		Re: Why is clustering limited up to 10000 molecules? By: avkitex on Thu, 03 March 2016 21:54
		Re: Why is clustering limited up to 10000 molecules? By: thomas on Fri, 04 March 2016 22:24
		Re: Why is clustering limited up to 10000 molecules? By: dataviz on Wed, 22 March 2017 11:34
		Re: Why is clustering limited up to 10000 molecules? By: thomas on Thu, 30 March 2017 20:35
		Re: Why is clustering limited up to 10000 molecules? By: E3ubiquitinligase on Thu, 10 January 2019 21:46
		Re: Why is clustering limited up to 10000 molecules? By: thomas on Fri, 11 January 2019 00:00
		Re: Why is clustering limited up to 10000 molecules? By: E3ubiquitinligase on Fri, 11 January 2019 07:21

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