Re: [Mzmine-devel] compound ID using online databases

2012-11-15 Thread Nicola WHEAT
Thanks for the reply. I tried my IT guy, who told me to contact you! I will continue to try getting it to work properly. Otherwise, thanks for creating a great program that's a nice alternative to the Agilent software we have here. best regards, Nicola >>> Tomas Pluskal 11/16/12 06:17 AM >>> Hi

Re: [Mzmine-devel] compound ID using online databases

2012-11-15 Thread Tomas Pluskal
Hi Nicola, Hello again - I have finally got some of the online identification working for my MZmine files. These are LipidMaps and PlantCyc. However, I am still not able to access and search CHEMSPIDER - it gives the error Also, when I queue up a METLIN search, it seems to start the process ju

Re: [Mzmine-devel] compound ID using online databases

2012-11-15 Thread Nicola WHEAT
Hello again - I have finally got some of the online identification working for my MZmine files. These are LipidMaps and PlantCyc. However, I am still not able to access and search CHEMSPIDER - it gives the error Also, when I queue up a METLIN search, it seems to start the process just fine -

Re: [Mzmine-devel] compound ID using online databases

2012-11-07 Thread Tomas Pluskal
Hi Nicola, You need to register at the METLIN website and receive the security token from there. http://metlin.scripps.edu/soap/register.php Cheers, Tomas On Nov 7, 2012, at 7:18 PM, Nicola WHEAT mailto:nicola.wh...@uct.ac.za>> wrote: Hi there - I have been using MZmine successfully up unti

[Mzmine-devel] compound ID using online databases

2012-11-07 Thread Nicola WHEAT
Hi there - I have been using MZmine successfully up until the point where I want to ID the compounds. I wanted to search the METLIN database and when I tried to start the process it asks for a METLIN security token and I can't get any further. Can you please help with what I need to do in order to