I love the information which leaks through in exception tracebacks. Use the SMILES 'Q' and call "http://apps.ideaconsult.net:8080/ambit2/depict/cactvs?search=Q" to see in the traceback "Caused by: http://cactus.nci.nih.gov/chemical/structure/Q/image?width=400&height=200 404 Not Found". The Daylight image traceback says "Caused by: http://www.daylight.com/daycgi/smi2gif?51202373" 500 Internal Server Error".
In other words, AMBIT does not run Daylight or CACTVS locally but instead proxies (and reformats) information from the primary interface.
The CDK image is hosted locally, with "Caused by: org.openscience.cdk.exception.InvalidSmilesException: Found element which is not a 'organic subset' element. You must use [Q]." (Interestingly, "C11" is accepted as a valid SMILES, but with a blank image.)
I love the information which leaks through in exception tracebacks. Use the SMILES 'Q' and call "http://apps.ideaconsult.net:8080/ambit2/depict/cactvs?search=Q" to see in the traceback "Caused by: http://cactus.nci.nih.gov/chemical/structure/Q/image?width=400&height=200 404 Not Found". The Daylight image traceback says "Caused by: http://www.daylight.com/daycgi/smi2gif?51202373" 500 Internal Server Error".
ReplyDeleteIn other words, AMBIT does not run Daylight or CACTVS locally but instead proxies (and reformats) information from the primary interface.
The CDK image is hosted locally, with "Caused by: org.openscience.cdk.exception.InvalidSmilesException: Found element which is not a 'organic subset' element. You must use [Q]." (Interestingly, "C11" is accepted as a valid SMILES, but with a blank image.)
Yeah, lovely :)
ReplyDeleteI also like it for comparing aromaticity models :)
And now with OpenBabel depiction added
ReplyDeletehttp://apps.ideaconsult.net:8080/ambit2/depict?search=OC%5BC%40%40H%5D%28O%29%5BC%40%40H%5D%28O%29CO