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GNPS Workflow Release 8

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@mwang87 mwang87 released this 16 Aug 18:50

This workflow release will be the one that starts to implement proper versioning of workflows. Historically metabolomics-snets-v2 has been version 1.2.3 and 1.2.5 which will now be equivalent to release_8. Tools will be deployed to location prefix 1.2.3 and 1.2.5 to be consistent with the workflow files. Tools will also be duplicated to release_8 locations to be consistent moving forward.

GNPS-Website

  1. Linkouts to NPAtlas
  2. Linkouts to MiBig

Feature Based Molecular Networking

  1. Bug fix for XCMS3 input
  2. Adding input quant table as part of output
  3. Bug fix for row sum norm
  4. Adding support for Progenesis
  5. Update result link outs to use new hostnames
  6. Add a direct add to libraries link

Classic Networking

  1. Update result link outs to use new hostnames

MASST Search

  1. Integration of Foodomics categorization and metadata
  2. bug fix for linking out to reanalyze with molecular networking
  3. Added link to annotate library spectrum