Prediction of chemical reactivity with a graph-convolutional neural network model

被引：0
|
作者：
Coley, Connor [1 ]
Jin, Wengong [2 ]
Rogers, Luke [1 ]
Jamison, Timothy [3 ]
Jaakkola, Tommi [2 ]
Green, William [4 ]
Barzilay, Regina [2 ]
Jensen, Klavs [5 ]
机构：
[1] MIT, Chem Engn, 77 Massachusetts Ave, Cambridge, MA 02139 USA
[2] MIT, CSAIL, 77 Massachusetts Ave, Cambridge, MA 02139 USA
[3] MIT, Chem 18 590, 77 Massachusetts Ave, Cambridge, MA 02139 USA
[4] MIT, Rm E17-504, Cambridge, MA 02139 USA
[5] MIT, Dept Chem Engn, Rm 66 350, Cambridge, MA 02139 USA
来源：
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY | 2019年 / 257卷
关键词：
D O I：
暂无
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
89
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收藏
页数：1
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