openmolecules.org Forum: Bug Reports » Pentavalent carbonyl issue (urea formation?)

Home » DataWarrior » Bug Reports » Pentavalent carbonyl issue (urea formation?) (Enumerating combinatorial library)

Show: Today's Messages :: Polls :: Message Navigator

Re: Pentavalent carbonyl issue (urea formation?) [message #1939 is a reply to message #1938]

Fri, 23 June 2023 09:26

thomas
Messages: 744
Registered: June 2014

Senior Member

Can you post the reaction as .rxn file, please? Or better a small macro containing the complete combinatorial library task with reaction and one real reactant for each generic reactant? This way I could directly reproduce the issue. Thanks in advance...

Report message to a moderator

[Message index]

		Pentavalent carbonyl issue (urea formation?) By: padster on Thu, 22 June 2023 21:14
		Re: Pentavalent carbonyl issue (urea formation?) By: thomas on Fri, 23 June 2023 09:26
		Re: Pentavalent carbonyl issue (urea formation?) By: padster on Fri, 23 June 2023 20:02
		Re: Pentavalent carbonyl issue (urea formation?) By: padster on Fri, 23 June 2023 20:27
		Re: Pentavalent carbonyl issue (urea formation?) By: thomas on Sat, 24 June 2023 16:53
		Re: Pentavalent carbonyl issue (urea formation?) By: padster on Sat, 24 June 2023 23:45
		Re: Pentavalent carbonyl issue (urea formation?) By: thomas on Sun, 25 June 2023 13:31
		Re: Pentavalent carbonyl issue (urea formation?) By: padster on Sun, 25 June 2023 20:56

Previous Topic:	conformer generation sometimes skips isomer generation
Next Topic:	conformer generation misses some entries

Goto Forum:

-=] Back to Top [=-

[ Syndicate this forum (XML) ] [

] [

]

Current Time: Wed Mar 25 22:13:00 CET 2026

Total time taken to generate the page: 0.00736 seconds