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Analyzing Learned Molecular Representations for Property Prediction.

Kevin Yang,Kyle Swanson,Wengong Jin,Connor Coley,Philipp Eiden,Hua Gao,Angel Guzman-Perez,Timothy Hopper,Brian Kelley,Miriam Mathea,Andrew Palmer,Volker Settels,Tommi Jaakkola,Klavs Jensen,Regina Barzilay

Journal of Chemical Information and Modeling（2019）

引用 1157|浏览116
关键词
Computational Chemistry,Property Predictions,Network Pharmacology
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