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Molecular Image-Based Prediction Models of Nuclear Receptor Agonists and Antagonists Using the DeepSnap-Deep Learning Approach with the Tox21 10K Library

The interaction of nuclear receptors (NRs) with chemical compounds can cause dysregulation of endocrine signaling pathways, leading to adverse health outcomes due to the disruption of natural hormones. Thus, identifying possible ligands of NRs is a crucial task for understanding the adverse outcome...

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Publicado en:Molecules
Main Authors: Matsuzaka, Yasunari, Uesawa, Yoshihiro
Formato: Artigo
Idioma:Inglês
Publicado: MDPI 2020
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Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC7356846/
https://ncbi.nlm.nih.gov/pubmed/32549344
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules25122764
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