Code to accompany preprint "Validating the Validation: Reanalyzing a large-scale comparison of Deep Learning and Machine Learning models for bioactivity prediction"
The manuscript can be cited as:
@misc{robinson2019validating,
title={Validating the Validation: Reanalyzing a large-scale comparison of Deep Learning and Machine Learning models for bioactivity prediction},
author={Matthew C. Robinson and Robert C. Glen and Alpha A. Lee},
year={2019},
eprint={1905.11681},
archivePrefix={arXiv},
primaryClass={cs.LG}
}
Please see the README file in the Mayr_reanalysis
folder for further important information regarding that section of the paper.