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Theoretical and Computational Chemistry

Working Paper

InFrag: Using Attribution-based Explainability to Guide Deep Molecular Optimization

Pierre Wüthrich, Jun Jin Choong, Shinya Yuki

Version 1 posted 13 September 2021

476

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Physical Chemistry

Working Paper

Photo-induced Energy Transfer Polymerization

Jian Liu, Yaxiong Wei, Liangwei Ma, Xin Jin, Siyu Sun, Meng Liu, Jun Du, Xinsheng Xu, He Tian, Xiang Ma

Version 2 posted 30 July 2024

322

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Organic Chemistry

Working Paper

Silver-Catalyzed Dearomative [2π+2σ] Cycloadditions of Indoles with Bicyclobutanes: Expedient Access to Indoline Fused Bicy-clo[2.1.1]hexanes

Lei Tang, Yuanjiu Xiao, Feng Wu, Jin-Lan Zhou, Tong-Tong Xu, Jian-Jun Feng

Version 1 posted 11 July 2023

730

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Materials Chemistry

Working Paper

Phononic Modulation of Spin-Lattice Relaxation in Molecular Qubit Frameworks

Aimei Zhou, Denan Li, Mingshu Tan, Yanpei Lv, Simin Pang, Xinxing Zhao, Zhifu Shi, Jun Zhang, Feng Jin, Shi Liu, Lei Sun

Version 3 posted 07 November 2024

489

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Materials Science

Working Paper

Molecular O2 Dimers and Lattice Instability in a Perovskite Electrocatalyst

Jan Bosse, Jian Gu, Jaewon Choi, Vladimir Roddatis, Yong-Bin Zhuang, Nagaarjhuna A. Kani, Anna Hartl, Mirian Garcia-Fernandez, Ke-Jin Zhou, Alessandro Nicolaou, Thomas Lippert, Jun Cheng, Andrew Akbashev

Version 2 posted 17 January 2024

792

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Organic Chemistry

Working Paper

Spontaneous Symmetry Breaking of Achiral Molecules Leading to the Formation of Homochiral Superstructures that Exhibit Mechanoluminescence

Zheng-Fei Liu, Xin-Yi Ye, Lihua Chen, Li-Ya Niu, Wei Jun Jin, Shaodong Zhang, Qing-Zheng Yang

Version 1 posted 26 October 2023

268

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Materials Chemistry

Working Paper

Impact of Spacer Cation on the Properties of Two-Dimensional Monolayer Hybrid Halide Perovskites

Chenchen Li, Xian Chen, Tan Jin, Tianmin Wu, Jun Chen, Wei Zhuang

Version 1 posted 16 August 2023

297

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1

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Energy

Working Paper

Does trapped O2 form in the bulk of LiNiO2 during charging?

Mikkel Juelsholt, Jun Chen, Miguel A. Pérez-Osorio, Gregory J. Rees, Sofia De Sousa Coutinho, Helen E. Maynard-Casely, Jue Liu, Michelle Everett, Stefano Agrestini, Mirian Garcia-Fernandez, Ke-Jin Zhou, Robert A. House, Peter Bruce

Version 1 posted 15 December 2023

761

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Organic Chemistry

Working Paper

Mechanistic Differences between Linear vs Spirocyclic Dialkyldiazirine Probes for Photoaffinity Labeling

Jessica O'Brien, Louis Conway, Paramesh Ramaraj, Appaso Jadhav, Jun Jin, Jason Dutra, Parrish Evers, Shadi Masoud, Manuel Schupp, Iakovos Saridakis, Yong Chen, Nuno Maulide, John Pezacki, Christopher am Ende, Christopher Parker, Joseph Fox

Version 1 posted 22 July 2024

250

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Organic Chemistry

Working Paper

C(sp2)−H Cyclobutylation of hydroxyarenes enabled by silver-π-acid catalysis: diastereocontrolled synthesis of 1,3-difunctionalized cyclobutanes

Lei Tang, Qi-Nan Huang, Feng Wu, Yuanjiu Xiao, Jin-Lan Zhou, Tong-Tong Xu, Wen-Biao Wu, Shuanglin Qu, Jian-Jun Feng

Version 1 posted 26 June 2023

662

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Refine Search

18 results in Jun Jin in Authors: Jun Jin

InFrag: Using Attribution-based Explainability to Guide Deep Molecular Optimization

Photo-induced Energy Transfer Polymerization

Silver-Catalyzed Dearomative [2π+2σ] Cycloadditions of Indoles with Bicyclobutanes: Expedient Access to Indoline Fused Bicy-clo[2.1.1]hexanes

Phononic Modulation of Spin-Lattice Relaxation in Molecular Qubit Frameworks

Molecular O2 Dimers and Lattice Instability in a Perovskite Electrocatalyst

Spontaneous Symmetry Breaking of Achiral Molecules Leading to the Formation of Homochiral Superstructures that Exhibit Mechanoluminescence

Impact of Spacer Cation on the Properties of Two-Dimensional Monolayer Hybrid Halide Perovskites

Does trapped O2 form in the bulk of LiNiO2 during charging?

Mechanistic Differences between Linear vs Spirocyclic Dialkyldiazirine Probes for Photoaffinity Labeling

C(sp2)−H Cyclobutylation of hydroxyarenes enabled by silver-π-acid catalysis: diastereocontrolled synthesis of 1,3-difunctionalized cyclobutanes

18 results in Authors: Jun Jin