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![[Graph Convolutional Network] by hand ✍️ Graph Convolutional Networks (GCNs), introduced by Thomas Kipf and Max Welling in 2017, have emerged as a powerful tool in the analysis and interpretation of data structured as graphs. This exercise demonstrates how GCN works in a simple application: binary classification. -- Goal -- Predict if a node in a graph is X. -- Architecture -- 🟪 Graph Convolutional Network (GCN) 1. GCN1(4,3) 2. GCN2(3,3) 🟦 Fully Connected Network (FCN) 1. Linear1(3,5) 2. ReLU 3. Linear2(5,1) 4. Sigmoid Simplications: • Adjacent matrices are not normalized. • ReLU is applied to messages directly. -- Walkthrough -- [1] Given ↳ A graph with five nodes A, B, C, D, E [2] 🟩 Adjacency Matrix: Neighbors ↳ Add 1 for each edge to neighbors ↳ Repeat in both directions (e.g., A->C, C->A) ↳ Repeat for both GCN layers [3] 🟩 Adjacency Matrix: Self ↳ Add 1's for each self loop ↳ Equivalent to adding the identity matrix ↳ Repeat for both GCN layers [4] 🟪 GCN1: Messages ↳ Multiply the node embeddings 🟨 with weights and biases ↳ Apply ReLU (negatives → 0) ↳ The result is one message per node [5] 🟪 GCN1: Pooling ↳ Multiply the messages with the adjacent matrix ↳ The purpose is the pool messages from each node's neighbors as well as from the node itself. ↳ The result is a new feature per node [6] 🟪 GCN1: Visualize ↳ For node 1, visualize how messages are pooled to obtain a new feature for better understanding ↳ [3,0,1] + [1,0,0] = [4,0,1] [7] 🟪 GCN2: Messages ↳ Multiply the node features with weights and biases ↳ Apply ReLU (negatives → 0) ↳ The result is one message per node [8] 🟪 GCN2: Pooling ↳ Multiply the messages with the adjacent matrix ↳ The result is a new feature per node [9] 🟪 GCN2: Visualize ↳ For node 3, visualize how messages are pooled to obtain a new feature for better understanding ↳ [1,2,4] + [1,3,5] + [0,0,1] = [2,5,10] [10] 🟦 FCN: Linear 1 + ReLU ↳ Multiply node features with weights and biases ↳ Apply ReLU (negatives → 0) ↳ The result is a new feature per node ↳ Unlike in GCN layers, no messages from other nodes are included. [11] 🟦 FCN: Linear 2 ↳ Multiply node features with weights and biases [12] 🟦 FCN: Sigmoid ↳ Apply the Sigmoid activation function ↳ The purpose is to obtain a probability value for each node ↳ One way to calculate Sigmoid by hand ✍️ is to use the approximation below: • >= 3 → 1 • 0 → 0.5 • <= -3 → 0 -- Outputs -- A: 0 (Very unlikely) B: 1 (Very likely) C: 1 (Very likely) D: 1 (Very likely) E: 0.5 (Neutral)](https://image.24vids.com/tw-1828407238408438145/ext_tw_video_thumb/1828407079696039936/pu/img/mjnHB1FbGJngAUIw.jpg)
