Research output per year
Research output per year
Description
Contains the results of library cleaning by matchms library cleaning pipelines.
ALL_GNPS_NO_PROPOGATED_21_08_2023.mgf library downloaded on 21-08-2023 from https://gnps-external.ucsd.edu/gnpslibrary/ALL_GNPS_NO_PROPOGATED.mgf
The 2 folders contain 2 different cleaning pipelines on the GNPS library.
Each folder contains:
A yaml file: This contains the settings used for this run. Should be used to rerun the pipeline with the same settings.
A .py file: This was the script used to run the pipeline. Not recommended to reuse, instead use the yaml file.
A .log file: Containing the log of the run. At the end the processing report is given.
A .mgf file: The cleaned library spectra.
ALL_GNPS_NO_PROPOGATED_21_08_2023.mgf library downloaded on 21-08-2023 from https://gnps-external.ucsd.edu/gnpslibrary/ALL_GNPS_NO_PROPOGATED.mgf
The 2 folders contain 2 different cleaning pipelines on the GNPS library.
Each folder contains:
A yaml file: This contains the settings used for this run. Should be used to rerun the pipeline with the same settings.
A .py file: This was the script used to run the pipeline. Not recommended to reuse, instead use the yaml file.
A .log file: Containing the log of the run. At the end the processing report is given.
A .mgf file: The cleaned library spectra.
| Date made available | 20 Nov 2023 |
|---|---|
| Publisher | Wageningen University & Research |
Research output
- 1 Preprint
-
Reproducible MS/MS library cleaning pipeline in matchms
de Jonge, N. F., Hecht, H., van der Hooft, J. J. J. & Huber, F., 27 Nov 2023, ChemRxiv, 11 p.Research output: Working paper › Preprint
Open Access