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The data set itself does not come with explicit edge features, so it depends on the algorithm you are using.
Some of them use one-hot encoding with dimension 4 for the type of the chemical bond (single, double, triple, aromatic).
Hello.
I'm doing an SMP experiment, and I found that the edge feature dimension is 4.
However, I couldn't figure out what each element stands for.
Could you give me some instruction about the features of edges of molecule?
Thank you.
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