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aurorarossi committed Dec 24, 2024
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*This tutorial is a Julia adaptation of the Pytorch Geometric tutorial that can be found [here](https://pytorch-geometric.readthedocs.io/en/latest/notes/colabs.html).*

In this tutorial session we will have a closer look at how to apply **Graph Neural Networks (GNNs) to the task of graph classification**.
Graph classification refers to the problem of classifying entire graphs (in contrast to nodes), given a **dataset of graphs**, based on some structural graph properties.
Graph classification refers to the problem of classifying entire graphs (in contrast to nodes), given a **dataset of graphs**, based on some structural graph properties and possibly on some input node features.
Here, we want to embed entire graphs, and we want to embed those graphs in such a way so that they are linearly separable given a task at hand.

The most common task for graph classification is **molecular property prediction**, in which molecules are represented as graphs, and the task may be to infer whether a molecule inhibits HIV virus replication or not.
A common graph classification task is **molecular property prediction**, in which molecules are represented as graphs, and the task may be to infer whether a molecule inhibits HIV virus replication or not.

The TU Dortmund University has collected a wide range of different graph classification datasets, known as the [**TUDatasets**](https://chrsmrrs.github.io/datasets/), which are also accessible via MLDatasets.jl.
Let's import the necessary packages. Then we'll load and inspect one of the smaller ones, the **MUTAG dataset**:
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