from_smiles should allow setting y (label)

[j-adamczyk]

🚀 The feature, motivation and pitch

Currently from_smiles (https://pytorch-geometric.readthedocs.io/en/latest/modules/utils.html#torch_geometric.utils.from_smiles) does not allow setting y (label). It should take such an argument, and pass it to Data it creates.

Alternatives

No response

Additional context

No response

[rusty1s]

The current design idea is to add labels afterwards. Does that work in your case?

[j-adamczyk]

I was getting a warning about y not being settable from PyCharm, but it went away after updating PyG. Probably due to @property for y being present, but not @y.setter. Anyway, it works, so I'm closing the issue