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GeMS (GNPS Experimental Mass Spectra)
This repository contains datasets used for the DreaMS project:
- GeMS dataset of up to hundreds of millions of unannotated MS/MS spectra mined from the MassIVE GNPS repository.
- DreaMS Atlas - a molecular network of 201 million MS/MS spectra constructed using DreaMS embeddings (built on top of the GeMS-C1 dataset).
- MS/MS spectra labeled with molecular structures used to fine-tune DreaMS (filtered subset of MoNA).
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