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For now, these utilities are simple, but we will Gaussian Process Hyperparameter OptimizationĭeepChem has some utilities to help find binding pockets on proteinsĪutomatically.Contributing a new dataset to MoleculeNet.Does MoleculeNet allow for releasing data under different licenses?.What if I want to release data? Can DeepChem help?.If I use DeepChem on my organization’s data, do I have to release the data?.I’m an aspiring scientist, not part of a lab.How can I do that as a DeepChem contributor? Won’t my contribution be lost in the noise? I want to establish my scientific niche.Do I need to add DeepChem team members as co-authors to my paper?.Wouldn’t it be better for my career to make my own package rather than use DeepChem?.