A Perspective on Explanations of Molecular Prediction Models

[Image: see text] Chemists can be skeptical in using deep learning (DL) in decision making, due to the lack of interpretability in “black-box” models. Explainable artificial intelligence (XAI) is a branch of artificial intelligence (AI) which addresses this drawback by providing tools to interpret D...

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Detalles Bibliográficos
Autores principales: Wellawatte, Geemi P., Gandhi, Heta A., Seshadri, Aditi, White, Andrew D.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10134429/
https://www.ncbi.nlm.nih.gov/pubmed/36972469
http://dx.doi.org/10.1021/acs.jctc.2c01235

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10134429/
https://www.ncbi.nlm.nih.gov/pubmed/36972469
http://dx.doi.org/10.1021/acs.jctc.2c01235

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