openmolecules.org Forum: Bug Reports » Issues with multiple columns of smiles in 5.0.0

Home » DataWarrior » Bug Reports » Issues with multiple columns of smiles in 5.0.0

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

Issues with multiple columns of smiles in 5.0.0 [message #443]

Tue, 15 January 2019 16:54

MarkG
Messages: 1
Registered: January 2019

Junior Member

It looks like 5.0.0 has issues opening text files with multiple smiles columns. At least, I'm having an issue with the below.

SMILES smiles2
Cc1ccccc1 OCCC
Cc1ccccc1 OCC
Cc1ccccc1 OC

If I copy/paste 'with header row', 5.0.0 hangs on my machine.

Report message to a moderator

[Message index]

		Issues with multiple columns of smiles in 5.0.0 By: MarkG on Tue, 15 January 2019 16:54
		Re: Issues with multiple columns of smiles in 5.0.0 By: thomas on Wed, 16 January 2019 23:41
		Re: Issues with multiple columns of smiles in 5.0.0 By: thomas on Thu, 17 January 2019 18:51

Previous Topic:	Trying to build OpenChemLib
Next Topic:	evolutionary algorithm

Goto Forum:

-=] Back to Top [=-

[ Syndicate this forum (XML) ] [

] [

]

Current Time: Thu Aug 21 04:24:10 CEST 2025

Total time taken to generate the page: 0.05643 seconds