Predicting drug compound potency using the BACE dataset with regression and classification models
-
Updated
Dec 18, 2024 - Jupyter Notebook
#
bace
Here are 2 public repositories matching this topic...
Benchmarking classical, graph, and quantum machine learning models for molecular property prediction on BACE, BBBP, and ClinTox.
benchmark cheminformatics reproducible-research scikit-learn pytorch quantum-computing drug-discovery qsar quantum-machine-learning graph-neural-networks pennylane qsvm molecular-property-prediction vqc hybrid-quantum-classical bbbp bace clintox
-
Updated
Jun 10, 2026 - Python
Add this topic to your repo
To associate your repository with the bace topic, visit your repo's landing page and select "manage topics."