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Theoretical and Computational Chemistry

Working Paper

Accurate Ring Strain Energy Predictions with Machine Learning and Application in Strain-Promoted Reactions

Zhen Liu, Jessica Vinskus, Yue Fu, Peng Liu, Kevin Noonan, Olexandr Isayev

Version 1 posted 19 November 2024

609

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Organometallic Chemistry

Working Paper

Synthesis and Characterization of Post-β-Carbon-Elimination Organopalladium Complexes

Taeho Kang, Yue Fu, Rei Matsuura, Anna Liu, Tanner Jankins, Arnold Rheingold, Jake Bailey, Milan Gembicky, Peng Liu, Keary Engle

Version 1 posted 01 November 2022

617

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Organic Chemistry

Working Paper

Chemo- and Enantioselective Intramolecular Silver-Catalyzed Aziridinations of Carbamimidates

Tuan Anh Trinh, Yue Fu, Derek Hu, Soren Zappia, Ilia Guzei, Peng Liu, Jennifer Schomaker

Version 1 posted 17 October 2023

548

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Theoretical and Computational Chemistry

Working Paper

A Zero-Shot Single-point Molecule Optimization Model: Mimicking Medicinal Chemists’ Expertise

Zhilian Dai, Jie Zhang, Songyou Zhong, Jiawei Fu, Yangyang Deng, Dan Zhang, Yichao Liu, Peng Gao

Version 1 posted 02 January 2025

313

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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

1,261

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Organic Chemistry

Working Paper

Au(I)-Catalyzed 6-endo-dig Cyclizations of Aromatic 1,5-Enynes to 2-(Naphthalen-2-yl)anilines Leading to Divergent Syntheses of Benzo[α]carbazole, Benzo[c,h]cinnoline and Dibenzo[i]phenanthridine Derivatives

Jiayue Fu, Bingbing Li, Xiugui Wang, Qida Liang, Xiaoshi Peng, Lu Yang, Tao Wan, Xinxiu Wang, Bin Lin, Maosheng Cheng, Yongxiang Liu

Version 1 posted 15 July 2021

304

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Catalysis

Working Paper

Scope and computational insights into enantioselective C–H amination through silver-catalyzed nitrene transfer

Emily Schroeder, Yue Fu, Jed Kim, Wentan Liu, Peng Liu, Jennifer Schomaker

Version 1 posted 09 August 2023

726

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Theoretical and Computational Chemistry

Working Paper

Theoretical study and wavefunction analysis of cyclo[18]carbon-benzene dimer

Fu Peng

Version 1 posted 11 July 2023

185

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Physical Chemistry

Working Paper

Thermally Activated Delayed Fluorescence from Locally Excited State: Theoretical Prediction and Experimental Validation

Xiaoxiao Xiao, Shuai Li, Hua Geng, Yuai Duan, Guo Wang, Qian Peng, Zhigang Shuai, Hongbing Fu, Yi Liao

Version 1 posted 29 July 2020

794

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1

Citations

Catalysis

Working Paper

Ortho-C–H Methoxylation of Aryl Halides Enabled by a Polarity Reversed N–O Reagent

Xin Liu, Yue Fu, Zhijie Chen, Peng Liu, Guangbin Dong

Version 1 posted 21 March 2023

1,510

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Refine Search

11 results in Fu Peng in Authors: Fu Peng

Accurate Ring Strain Energy Predictions with Machine Learning and Application in Strain-Promoted Reactions

Synthesis and Characterization of Post-β-Carbon-Elimination Organopalladium Complexes

Chemo- and Enantioselective Intramolecular Silver-Catalyzed Aziridinations of Carbamimidates

A Zero-Shot Single-point Molecule Optimization Model: Mimicking Medicinal Chemists’ Expertise

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

Au(I)-Catalyzed 6-endo-dig Cyclizations of Aromatic 1,5-Enynes to 2-(Naphthalen-2-yl)anilines Leading to Divergent Syntheses of Benzo[α]carbazole, Benzo[c,h]cinnoline and Dibenzo[i]phenanthridine Derivatives

Scope and computational insights into enantioselective C–H amination through silver-catalyzed nitrene transfer

Theoretical study and wavefunction analysis of cyclo[18]carbon-benzene dimer

Thermally Activated Delayed Fluorescence from Locally Excited State: Theoretical Prediction and Experimental Validation

Ortho-C–H Methoxylation of Aryl Halides Enabled by a Polarity Reversed N–O Reagent

11 results in Authors: Fu Peng