http://sneumann.pip.verisignlabs.com/'s Workflows

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Workflow In-silico Fragmentation of Naringenin (2)

This is the equivalent of the MetFrag Interface found on http://msbi.ipb-halle.de/MetFrag/ It takes a Speclipse Spectrum and a Bioclipse Molecule and runs MetFrag.  

Created: 2010-02-08

Credits: User http://sneumann.pip.verisignlabs.com/

Workflow getTimololFromMassBank (1)

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This workflow will retrieve a peaklist from a fixed entry (Timolol) from the MassBank spectral library. Note, the API is still in alpha, as of 10.11.2009.  

Created: 2009-11-10 | Last updated: 2009-11-10

Credits: User http://sneumann.pip.verisignlabs.com/

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