Dlux804 / McQuade-Chem-ML

Development of easy to use and reproducible ML scripts for chemistry.
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Hot fix neo4j bug #81

Closed qle2 closed 4 years ago

qle2 commented 4 years ago

This small PR was created mainly to fix a neo4j bug that causes errors when importing an untuned model.

For Adaboost's bayes grid in grid.py, splitter='best' was removed since it was a default option and criterion='friedman_mse' was added since it was recommended to be better than regular mse in Gradient Boosting Regressor