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Re: Combinatorial library issues [message #874 is a reply to message #871]

Sun, 26 April 2020 18:24

thomas
Messages: 731
Registered: June 2014

Senior Member

Hi Angus,
I have tried to reproduce with the current development version and with 5.2.1. In both cases I don't get an error. Strange is also the mapping, which in your picture doesn't complete. When I manually map just two or three of your manually mapped atoms, then all the others are automatically mapped.

Do you use an older version than 5.2.1? If yes, I suggest to update to 5.2.1 and then even replace with newest builds from openmolecules.org/datwarrior/dw521win.zip (or dw521x.zip for Linux or Mac).

Thomas

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[Message index]

		Combinatorial library issues By: timritchie on Sat, 28 March 2020 12:24
		Re: Combinatorial library issues By: thomas on Sun, 29 March 2020 14:08
		Re: Combinatorial library issues By: amorrison on Fri, 24 April 2020 10:45
		Re: Combinatorial library issues By: thomas on Sun, 26 April 2020 18:24
		Re: Combinatorial library issues By: amorrison on Mon, 27 April 2020 13:41

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