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Convolutional Embedding of Attributed Molecular Graphs for Physical Property Prediction
Submitted on
Fri, 2018-04-27 01:10
Title
Convolutional Embedding of Attributed Molecular Graphs for Physical Property Prediction
Publication Type
Journal Article
Year of Publication
2017
Authors
Connor W. Coley
Regina Barzilay
William H. Green
Tommi S. Jaakkola
Klavs F. Jensen
Journal
Journal of Chemical Information & Modeling
Volume
57
Pagination
1757-1772
Keywords
DOI
http://dx.doi.org/http://dx.doi.org/10.1021/acs.jcim.6b00601
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