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Theoretical and Computational Chemistry

Working Paper

General QSPR Protocol for Atomic/Inter-atomic Properties Predictions: Fragments based Graph Convolutional Neural Network (F-GCN)

Peng Gao, Jie Zhang, Hongbo Qiu, Shuaifei Zhao

Version 1 posted 23 February 2021

363

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Materials Science

Working Paper

Ultralong Room Temperature Phosphorescence from Purely Organic Cluster Excitons

Xuepeng Zhang, Lili Du, Weijun Zhao, zheng zhao, Xuewen He, Peng Fei Gao, Parvej Alam, Jacky W. Y. Lam, David Lee Phillips, Guoqing Zhang, Ben Zhong Tang

Version 1 posted 16 July 2019

1,586

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Biological and Medicinal Chemistry

Working Paper

Theoretical Study of the anti-NCP Molecular Mechanism of Traditional Chinese Medicine Lianhua-Qingwen Formula (LQF)

Chenghao Ye, Meina Gao, Wangqiang Lin, Kunqian Yu, Peng Li, Guanghui Chen

Version 1 posted 23 March 2020

3,194

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2

Citations

Materials Science

Working Paper

Synthesis of Germanosilicate Zeolite HPM-12 Using a Short Imidazolium-based Dication: Structure-Direction by Charge-to-Charge Distance Matching

Peng Lu, Luis Gómez-Hortigüela, Zihao Gao, Miguel Camblor

Version 1 posted 23 October 2019

436

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Organic Chemistry

Working Paper

Cascade CuH-Catalyzed Conversion of Alkynes to Enantioenriched 1,1-Disubstituted Products

De-Wei Gao, Yang Gao, Huiling Shao, Tian-Zhang Qiao, Xin Wang, Brittany Sanchez, Jason Chen, Peng Liu, Keary Engle

Version 1 posted 09 April 2019

1,498

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Catalysis

Working Paper

Asymmetric Three-Component Olefin Dicarbofunctionalization Enabled by Photoredox and Copper Dual Catalysis

Peng-Zi Wang, Yuan Gao, Jun Chen, Xiao-Die Huan, Wen-Jing Xiao, Jia-Rong Chen

Version 1 posted 14 December 2020

574

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1

Citations

Biological and Medicinal Chemistry

Working Paper

Double Lock the COVID 19: Inhibit SARS COV 2 Replication and Suppress Inflammation Cytokine Level by the Golden Compounds

Zhesheng He, Chunyu Zhang, Zhongying Du, Wencong Zhao, Wenchao Niu, Yucong Gao, Yuhui Dong, Jiadong Fan, Bo he, Peng Cao, Huaidong Jiang, Gong Yong, Xueyun Gao

Version 1 posted 29 June 2020

537

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Polymer Science

Working Paper

SuFExable Polymers with Helical Structures Derived from Thionyl Tetrafluoride (SOF4)

Suhua Li, Gencheng Li, Bing Gao, Sidharam P. Pujari, Xiaoyan Chen, Hyunseok Kim, Feng Zhou, Liana M. Klivansky, Yi Liu, Hafedh Driss, Rachael E. Impey, Tatiana P. Soares da Costa, Jianmei Lu, Peng Wu, Han Zuilhof, John E. Moses, K. Barry Sharpless

Version 1 posted 23 October 2019

1,122

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Organic Chemistry

Working Paper

Ligand-Controlled Regiodivergence in Nickel-Catalyzed Hydroarylation and Hydroalkenylation of Alkenyl Carboxylic Acids

Zi-Qi Li, Yue Fu, Ruohan Deng, Van Tran, Yang Gao, Peng Liu, Keary Engle

Version 1 posted 15 July 2020

1,225

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Theoretical and Computational Chemistry

Working Paper

A General Protocol for the Accurate Predictions of Molecular 13C/1H NMR Chemical Shifts via Machine Learning

Peng Gao, Jun Zhang, Qian Peng, Vassiliki-Alexandra Glezakou

Version 1 posted 10 December 2019

912

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Refine Search

19 results in PENG GAO in Authors: PENG GAO

General QSPR Protocol for Atomic/Inter-atomic Properties Predictions: Fragments based Graph Convolutional Neural Network (F-GCN)

Ultralong Room Temperature Phosphorescence from Purely Organic Cluster Excitons

Theoretical Study of the anti-NCP Molecular Mechanism of Traditional Chinese Medicine Lianhua-Qingwen Formula (LQF)

Synthesis of Germanosilicate Zeolite HPM-12 Using a Short Imidazolium-based Dication: Structure-Direction by Charge-to-Charge Distance Matching

Cascade CuH-Catalyzed Conversion of Alkynes to Enantioenriched 1,1-Disubstituted Products

Asymmetric Three-Component Olefin Dicarbofunctionalization Enabled by Photoredox and Copper Dual Catalysis

Double Lock the COVID 19: Inhibit SARS COV 2 Replication and Suppress Inflammation Cytokine Level by the Golden Compounds

SuFExable Polymers with Helical Structures Derived from Thionyl Tetrafluoride (SOF4)

Ligand-Controlled Regiodivergence in Nickel-Catalyzed Hydroarylation and Hydroalkenylation of Alkenyl Carboxylic Acids

A General Protocol for the Accurate Predictions of Molecular 13C/1H NMR Chemical Shifts via Machine Learning

19 results in Authors: PENG GAO