Allow multiple loss functions #1044
Labels
enhancement
New feature or request
ml
Issues related to the machine learning parts of this package
science
For deal with scientific questions
We've tossed around ideas for training that include incorporating additional loss terms on top of the pure target value loss, eg penalizing for predictions outside a normal pIC50 range, additional cross entropy loss to ensure the best predicted pose is the closes to the crystal structure, etc.
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