Dataset Viewer
The dataset viewer is not available for this dataset.
Unexpected token '<', "<html>
<h"... is not valid JSON
Need help to make the dataset viewer work? Make sure to review how to configure the dataset viewer, and open a discussion for direct support.
Biogen ADME hPPB
Biogen_ADME_hPPB dataset from the Biogen ADME benchmark [1]. It is intended to be used through scikit-fingerprints library.
The task is to predict log10 of human plasma protein binding (% unbound) of molecules.
| Characteristic | Description |
|---|---|
| Tasks | 1 |
| Task type | regression |
| Total samples | 194 |
| Recommended split | time |
| Recommended metric | MAE |
References
[1] Fang, Cheng, et al. "Prospective Validation of Machine Learning Algorithms for Absorption, Distribution, Metabolism, and Excretion Prediction: An Industrial Perspective" J. Chem. Inf. Model. 2023, 63, 11, 3263-3274 https://doi.org/10.1021/acs.jcim.3c00160
- Downloads last month
- 199