Comments (3)
How are you accessing this? I don’t provide any of those API points.
Mainly curious.
The web API (I have not idea what api you are using) expects a SMARTS and not a SMILES. There is a subtle difference but you’ve queried for a nitrogen with a hydrogen attached but there are none.
“c1ncnc1”
Or
“c1nc[nX3]c1”
from depict.
Past github requests of this issue have disappeared??
I think you might have the wrong project? We’ve not deleted any
from depict.
Closing - not CDK depict related, please provide more info if think this is incorrect
from depict.
Related Issues (20)
- missing stereo in CXSMILES depiction HOT 7
- relabelling of atoms is possible? HOT 4
- What are the query params? HOT 2
- Missing charges HOT 1
- atom numbering based on the InChI HOT 16
- thoughts about input of .sdf (version 3000) / extended stereochemistry HOT 2
- mark missing stereo HOT 3
- bug in atom placement on for image render - specific smiles HOT 1
- Bug in depicting CXSMILES with Stereochemistry HOT 8
- www.simolecule.com does not work anymore HOT 2
- Flip should flip stereobond HOT 1
- feature request: generating multiple molecue structures within one image HOT 1
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- Aromatic display HOT 2
- CDK Depict website appears to be down HOT 5
- "White on clear" / "Neon on clear" options? HOT 2
- Feature request: MOL or single-molecule SDF as output? HOT 3
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from depict.