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GNPS Theoretical/Insilico Tools and Libraries

Insilico Peptidic Natural Product Dereplicator

Dereplication of Peptidic Natural Product workflow. This analysis will compare your experimental MS/MS spectra against chemical structure databases, e.g. PubChem, etc. This workflow is currently in beta development stages so any feedback is welcome to improve analysis and usability. It is available here. View documentation.

Peptidogenomics for Ribosomally Synthesized Post-translationally Modified Peptides (RiPPs) - RiPPquest

Identification of RiPP Natural Products workflow. This analysis will compare your experimental MS/MS spectra against full genome sequences to mine them for possible RiPP natural products. This workflow is currently in beta development stages so any feedback is welcome to improve analysis and usability. It is available here.
Copyright © 2017. Last modified: 2017-05-22. Version 1.3.0-GNPS.