Validating the validation: reanalyzing a large-scale comparison of deep learning and machine learning models for bioactivity prediction.

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Authors

Robinson, Matthew C

  Glen, Robert

  Lee, Alpha

Publication Date

2020-07

Journal Title

Journal of computer-aided molecular design

ISSN

0920-654X

Volume

34

Issue

7

Pages

717-730

Language

eng

Type

Article

This Version

VoR

Physical Medium

Print-Electronic

Metadata

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Citation

Robinson, M. C., Glen, R., & Lee, A. (2020). Validating the validation: reanalyzing a large-scale comparison of deep learning and machine learning models for bioactivity prediction.. Journal of computer-aided molecular design, 34 (7), 717-730. https://doi.org/10.1007/s10822-019-00274-0

Identifiers

External DOI: https://doi.org/10.1007/s10822-019-00274-0

This record's URL: https://www.repository.cam.ac.uk/handle/1810/303331



Rights

Attribution 4.0 International

Licence URL: https://creativecommons.org/licenses/by/4.0/