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Re: Problemin exporting structures as SMILES generated from evolutionary library into excel [message #1346 is a reply to message #1344]

Mon, 19 July 2021 09:53

thomas
Messages: 734
Registered: June 2014

Senior Member

You can generate a column containing SMILES from the 'Chemistry' menu with 'From Chemical Structure->Add SMILES Code...'.
Then Copy/Paste or 'Save Special->Text File...' will include the SMILES column.

Thomas

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		Problemin exporting structures as SMILES generated from evolutionary library into excel By: Jo W on Sun, 18 July 2021 10:44
		Re: Problemin exporting structures as SMILES generated from evolutionary library into excel By: thomas on Mon, 19 July 2021 09:53

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