matchms / ms2deepscore

Deep learning similarity measure for comparing MS/MS spectra with respect to their chemical similarity
Apache License 2.0
52 stars 23 forks source link

Integrate train in class #206

Closed niekdejonge closed 7 months ago

niekdejonge commented 7 months ago

Small changes to improve clarity of embeddingsEvaluator

florian-huber commented 7 months ago

Nice cleanup @niekdejonge . Thanks!