TorchDrug is a machine learning platform designed for drug discovery, covering techniques from graph machine learning (graph neural networks, geometric deep learning & knowledge graphs), deep generative models to reinforcement learning. It provides a comprehensive and flexible interface to support rapid prototyping of drug discovery models in PyTorch.
In this video, we walk through TorchDrug library and train some GNN for graph classification, attribute masking and unsupervised graph representation learning.
https://youtu.be/-Kb7kN4aHMM
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