Usability tweaks & new featurizer preset - Githubissues

ppdebreuck / modnet

MODNet: a framework for machine learning materials properties

MIT License

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Usability tweaks & new featurizer preset #215

Closed ml-evs closed 6 months ago

ml-evs commented 7 months ago

Added ability to disable o-o-b remapping in predictions
Better error messages
FastFeaturizer preset
Structure IDs taken from df_featurized if present