Methods Resources
Learning resources for ML methods in science.
Deep Learning Fundamentals
Neural Networks: Zero to Hero
github.com/karpathy/nn-zero-to-hero
Andrej Karpathy’s tutorial series — the best starting point for understanding neural networks.
Graph Neural Networks
| Resource | Description |
|---|---|
| DeepChem Tutorials | GNNs for molecular property prediction |
| PyTorch Geometric Tutorials | General GNN tutorials |
Transformers & Language Models
| Resource | Description |
|---|---|
| Transformers for Chemistry | LLMs in chemistry and materials |
| awesome-scientific-language-models | Comprehensive list of scientific LLMs |
Generative Models
| Resource | Description |
|---|---|
| AI4Chemistry Course | Includes generative models for chemistry |
Awesome Lists
| List | Focus |
|---|---|
| awesome-learning-digital-chemistry | General learning resources |
| awesome-scientific-language-models | Scientific LLMs |