Test train split testing MS2Query 2

Zenodo (CERN European Organization for Nuclear Research) 2026 Dataset Open access

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Authors: Niek De Jonge
DOI: 10.5281/zenodo.18801894
Cited by: 0

Abstract

The inchikeys used for the test train split for testing new architectures for MS2Query 2

Fields of Study & Subjects

Computational Drug Discovery Methods Mass Spectrometry Techniques and Applications Machine Learning in Materials Science

Publication details

Journal / source
Zenodo (CERN European Organization for Nuclear Research)
Publication date
27 February 2026
Language
EN
Document type
Dataset