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GGL-Tox: Geometric Graph Learning for Toxicity Prediction

Toxicity analysis is a major challenge in drug design and discovery. Recently significant progress has been made through machine learning due to its accuracy, efficiency, and lower cost. US Toxicology in the 21st Century (Tox21) screened a large library of compounds, including approximately 12 000 e...

Disgrifiad llawn

Wedi'i Gadw mewn:
Manylion Llyfryddiaeth
Cyhoeddwyd yn:J Chem Inf Model
Prif Awduron: Jiang, Jian, Wang, Rui, Wei, Guo-Wei
Fformat: Artigo
Iaith:Inglês
Cyhoeddwyd: 2021
Pynciau:
Mynediad Ar-lein:https://ncbi.nlm.nih.gov/pmc/articles/PMC8155789/
https://ncbi.nlm.nih.gov/pubmed/33719422
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jcim.0c01294
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