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yoshida-lab / XenonPy

XenonPy is a Python Software for Materials Informatics
http://xenonpy.readthedocs.io
BSD 3-Clause "New" or "Revised" License
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Default GaussLogLikelihood predict function missing return_std=True #177

Closed stewu5 closed 3 years ago

stewu5 commented 4 years ago

In the tutorial of iQSPR, after executing iQSPR loop, prd_mdls["E"].predict(tmp_fps) may return error due to missing "return_std=True"