Change Log

Change Log of GNPS Documentation

5/3/2019

• GNPS Workflow Release 3

4/8/2019

• Update documentation for DEREPLICATOR tools.
• Update the index.md.

4/5/2019

• New documentation for Feature-Based Molecular Networking (FBMN).
• New tools available with the FBMN OpenMS, MS-DIAL, XCMS, and MetaboScape.

3/9/2019

• Adding qiime2 qza and emperor output for Feature Based Molecular Networking
• Adding GraphML output for MS2LDA
• GNPS Quickstart will do only the fly conversion of Thermo raw files.

2/5/2019

• Adding credentials option for GNPS quickstart for classic molecular Networking
• Adding link to clone deprecated molecular networking to latest version of molecular networking
• Adding direct re-analysis link for MS2LDA from molecular networking
• Bug fixes for MS2LDA
• Adding batch spectra additional validator

12/27/2018

• GNPS quickstart support within MZMine2 updated

11/1/2018

• Added UniqueFileCount to GraphML in Classic Molecular Networking
• Added GNPS Cluster Linkouts and GNPS Network Visualizer linkouts to GraphML in Classic Molecular Networking

10/28/2018

• Feature based molecular networking is supported in the superquick start page
• Feature based molecular networking now supports MZMine2, OpenMS, Optimus, MS-DIAL, Metaboscape, and XCMS3 feature finding tools

10/26/2018

• Adding UniqueFileSource attribute to GNPS Molecular Networking V2 Workflow (METABOLOMICS-SNETS-V2)

9/5/2018

• Mirror plots include mz labels
• MASST supports dataset metadata display

8/1/2018

• New Documentation and Splash Page are available
• Bug Fixes for Library Search to provide 10X increase in throughput for large datasets
• MASST is available to report MS/MS spectrum occurrences at a single file level with metadata reported if available

6/27/2018

• Updating documentation

6/1/2018

• New documentation website.
• Beta version of Molecular Networking provides stream lined results and cytoscape compliant output.