| Re: Count # scaffolds by plate ID [message #1282 is a reply to message #1281] |
Wed, 05 May 2021 23:23   |
chemtv
Messages: 25
Registered: February 2015
Location: Indianapolis
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Junior Member |
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Starting with: 500K smiles, cpdID, plateID
Here's what I'm ultimately trying to get to...
plateID | Num Scaffolds | Scaffolds (smiles of scaffold)
------------------------------------------------------------ ----------
abc01 | 5 | phenyl, pyridine, indole, thiazole, napthyl
abc02 | 3 | phenyl, pyrimidine, napthyl
abc03 | 2 | indole, oxazole
Actually the 1st two columns are what I need.
Greg
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