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6 results in Authors: Xu Jun Zheng

Theoretical and Computational Chemistry

Working Paper

Identifying Structure-Property Relationships through SMILES Syntax Analysis With Self-Attention Mechanism

Shuangjia Zheng, Xin Yan, Yuedong Yang, Jun Xu

Version 2 posted 14 November 2018

2,727

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Theoretical and Computational Chemistry

Working Paper

SyntaLinker: Automatic Fragment Linking with Deep Conditional Transformer Neural Networks

Yuyao Yang, Shuangjia Zheng, Shimin Su, Jun Xu, Hongming Chen

Version 5 posted 22 May 2020

2,000

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Theoretical and Computational Chemistry

Working Paper

Predicting Retrosynthetic Reaction using Self-Corrected Transformer Neural Networks

Shuangjia Zheng, Jiahua Rao, Zhongyue Zhang, Jun Xu, Yuedong Yang

Version 1 posted 03 July 2019

805

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Materials Science

Working Paper

Toughening Hydrogels Through Force-triggered Chemical Reactions that Lengthen Polymer Strands

Zi Wang, Xu Jun Zheng, Tetsu Ouchi, Tatiana Kouznetsova, Haley Beech, Sarah Av-Ron, Brandon Bowser, Shu Wang, Jeremiah Johnson, Julia Kalow, Bradley Olsen, Jian Ping Gong, Michael Rubinstein, Stephen Craig

Version 1 posted 04 January 2021

2,104

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Inorganic Chemistry

Working Paper

Linker Deficiency, Aromatic Ring Fusion and Electrocatalysis in a Porous Ni8 Pyrazolate Network

Jieying Hu, Xiangling Deng, Hu Zhang, Yingxue Diao, Shengxian Cheng, Sai-Li Zheng, Wei-Ming Liao, Jun He, Zhengtao Xu

Version 1 posted 12 October 2020

437

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Theoretical and Computational Chemistry

Working Paper

A Deep Learning Based Scaffold Hopping Strategy for the Design of Kinase Inhibitors

Lizhao Hu, Yuyao Yang, Shuangjia Zheng, Jun Xu, Ting Ran, Hongming Chen

Version 1 posted 24 May 2021

773

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6 results in Xu Jun Zheng in Authors: Xu Jun Zheng

Identifying Structure-Property Relationships through SMILES Syntax Analysis With Self-Attention Mechanism

SyntaLinker: Automatic Fragment Linking with Deep Conditional Transformer Neural Networks

Predicting Retrosynthetic Reaction using Self-Corrected Transformer Neural Networks

Toughening Hydrogels Through Force-triggered Chemical Reactions that Lengthen Polymer Strands

Linker Deficiency, Aromatic Ring Fusion and Electrocatalysis in a Porous Ni8 Pyrazolate Network

A Deep Learning Based Scaffold Hopping Strategy for the Design of Kinase Inhibitors

6 results in Authors: Xu Jun Zheng