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GNNs for Protein Interaction Prediction
Chen et al. · Nature MI · 2024
Molecule Generation with Flow Matching
Okafor et al. · NeurIPS · 2024
Graph Contrastive Learning at Scale
Lindqvist et al. · ICML · 2024
supplementary.pdf
2.4 MB · May 10
dataset_v4.csv
340 KB · May 8
Benchmarking strategy
Compare against RDKit baselines before scaling up. Keep the seed list at 42 for reproducibility…
Edited 1d ago
Open questions for lab meeting
Do we keep the molecular weight filter? How do we handle stereochemistry in batch 3?
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| Name | Type | Size | Modified | ||
|---|---|---|---|---|---|
| gann_survey.pdf | 2.4 MB | May 12 | ⋮ | ||
| graphs_notes.docx | DOCX | 1.1 MB | May 10 | ⋮ | |
| dataset.csv | CSV | 340 KB | May 8 | ⋮ | |
| slides.pptx | PPTX | 5.2 MB | May 6 | ⋮ |
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