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Biological and Medicinal Chemistry

Working Paper

A novel “activation switch” motif common to all aminergic receptors

Kuo Hao Lee, Jamie Manning, Jonathan Javitch, Lei Shi

Version 1 posted 12 May 2023

191

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Organic Chemistry

Working Paper

Strained delta-stacked motifs of nanogridarenes achieved via Pd-PPh3-controlled diastereoselective C-H gridization

Linghai Xie, Ying Wei, Wei Huang, Xiangping Wu, Yongxia Wang, Yue Sun, Xue Du, Yongxia Yan, Chaoyang Dong, Wenjing Shi, Yuyu Liu, Juan Song, Lei YANG

Version 1 posted 25 July 2022

236

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Theoretical and Computational Chemistry

Working Paper

A comprehensive evaluation of the potential binding poses of fentanyl and its analogs at the µ-opioid receptor

Bing Xie, Alexander Goldberg, Lei Shi

Version 2 posted 17 February 2022

450

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Biological and Medicinal Chemistry

Working Paper

Dynamic extracellular vestibule of human SERT: unveiling druggable potential with novel high-affinity allosteric inhibitors

Kristine Salomon, Ara Abramyan, Per Plenge, Lingle Wang, Benny Bang-Andersen, Claus Loland, Lei Shi

Version 1 posted 13 March 2023

181

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1

Citations

Theoretical and Computational Chemistry

Working Paper

An invertible, invariant crystallographic representation for inverse design of solid-state materials using generative deep learning

Hang Xiao, Rong Li, Xiaoyang Shi, Yan Chen, Liangliang Zhu, Lei Wang, Xi Chen

Version 1 posted 22 May 2023

559

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Materials Science

Working Paper

Post-Pretraining Large Language Model Enabled Reverse Design of MOFs for Hydrogen Storage

Zhimeng Liu, Yuqiao Su, Yujie Guo, Jing Lin, Shulin Wang, Zeyang Song, Zuoshuai Xi, Hongyi Gao, Lei Shi, Ge Wang

Version 1 posted 21 March 2024

133

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Theoretical and Computational Chemistry

Working Paper

Detailed Complementary Consistency: Wave Function Tells Particle How to Hop, Particle Tells Wave Function How to Collapse

Lei Huang, Zhecun Shi, Linjun Wang

Version 1 posted 05 April 2024

50

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Materials Science

Working Paper

Wall- and Hybridisation-Selective Synthesis of Nitrogen-Doped Double-Walled Carbon Nanotubes

Marco Carini, Lei Shi, Thomas Chamberlain, Meng Liu, Giovanni Valenti, Manuel Melle-Franco, Francesco Paolucci, Andrei Khlobystov, Thomas Pichler, Aurelio Mateo-Alonso

Version 1 posted 17 May 2019

397

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Refine Search

8 results in Lei Shi in Authors: Lei Shi

A novel “activation switch” motif common to all aminergic receptors

Strained delta-stacked motifs of nanogridarenes achieved via Pd-PPh3-controlled diastereoselective C-H gridization

A comprehensive evaluation of the potential binding poses of fentanyl and its analogs at the µ-opioid receptor

Dynamic extracellular vestibule of human SERT: unveiling druggable potential with novel high-affinity allosteric inhibitors

An invertible, invariant crystallographic representation for inverse design of solid-state materials using generative deep learning

Post-Pretraining Large Language Model Enabled Reverse Design of MOFs for Hydrogen Storage

Detailed Complementary Consistency: Wave Function Tells Particle How to Hop, Particle Tells Wave Function How to Collapse

Wall- and Hybridisation-Selective Synthesis of Nitrogen-Doped Double-Walled Carbon Nanotubes

8 results in Authors: Lei Shi