TL;DR: I was three days into a 72-hour pre-training run on a molecular property prediction task when I checked the loss curves and realized something was deeply wrong — not with my hyperparameters, but with my entire approach. My Transformer was burning A100 time learning that atoms bo
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What's in this article
The Problem: Pre-Training Is Eating Your GPU Budget
What Geometric Deep Learning Actually Gives You (Practically Speaking)
Setting Up PyTorch Geometric Without Breaking Your Environment
Building Your First Graph-Structured Model That Skips the Pre-Training Grind
Replacing the Pre-Training Phase: What the Workflow Looks Like in Practice
The 3 Things That Surprised Me After Switching
When GDL Doesn't Help and You Still Need Pre-Training
Quick Reference: PyG vs.…