Published August 10, 2020
| Version v1
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Pretrained Spec2Vec model (trained on GNPS UniqueInchikey dataset)
Description
Pretrained Gensim Word2Vec model for Spec2Vec:
The model was trained for 50 iterations on the "UniqueInchikey" subset (12,797 spectra after filtering) of GNPS positive ionmode mass spectra as fully described here https://github.com/iomega/spec2vec_gnps_data_analysis/blob/master/notebooks/iomega-5-train-spec2vec-model.ipynb.
Used for the Plos Computational Biology article on Spec2Vec --> https://doi.org/10.1371/journal.pcbi.1008724
Files
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(265.0 MB)
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md5:a7333c19ace863c5a0a04abc89600f49
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128.9 MB | Download |
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128.9 MB | Download |
Additional details
Related works
- Is part of
- Journal article: 10.1371/journal.pcbi.1008724 (DOI)