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Highly efficient synthesis of hydrogen-bonded aromatic tetramers as macrocyclic receptors for selective recognition of lithium ions

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ORGANIC CHEMISTRY FRONTIERS 2019年第15期6卷 2654-2661页

作者： Guo, xuwen Yang, Yizhou Peng, Zhiyong Cai, Yimin feng, Wen Yuan, Lihua Sichuan Univ Coll Chem Key Lab Radiat Phys & Technol Minist Educ Chengdu 610064 Sichuan Peoples R China

Persistently folded aromatic amide macrocycles comprising four monomeric units (biphenyl-cyclo[4]aramide) were synthesized with high efficiency via a one-step approach along with the larger cyclic oligomer, biphenyl-cyclo[8]aramide as a minor product. Such cyclic hydrogen-bonded aromatic tetramers feature four amide oxygens enclosing a cavity with small dimensions, enabling the selective complexation of alkali metal ions, particularly Li+, with high affinity. The cyclization efficiency and selectivity of smaller macrocycles was further improved using fragment coupling and Li+-based template approaches. In addition, the superior binding ability of biphenyl-cyclo[4]aramide towards Li+ over its acyclic analogues was observed, demonstrating a remarkable macrocyclic effect.

关键词： Amides

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Interaction Between Tangeretin and Ovalbumin to Reduce the Allergic Effects of Ovalbumin

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Chemical Research in Chinese Universities 2016年第4期32卷 556-560页

作者： SHI Xiaolei ZHANG Ting LI xuwen feng Yu TAN Xin JIN Yongri College of Food Science and Engineering Jilin University Changchun 130062 P. R. China College of Chemistry Jilin University Changchun 130012 P. R. China

Food allergy has become a worldwide problem. To find an effective way to reduce the allergic effect of allergen is an interesting topic. In this work, the interaction between ovalbumin（OVA） and tangeretin was studied by means of spectroscopy, molecular docking calculation and animal experiment. As the results show, static quenching of fluorescence intensity happened due to the interaction between OVA and tangeretin. Binding constants, binding sites, and thermometric parameters were obtained. The conformation changing of OVA occurred due to the interaction between it and tangeretin. The molecular docking calculation results show that the epitopes Arginine 84（ARG84）, Leucine 87（LEU87）, Asparagine 88（ASN88）, Serine 103（SER103）, Arginine 104（ARG104）, Leucine 124（LEUI24）, Arginine 126（ARG126）, Glycine 127（GLY127）, Glycine 128（GLY128） and Tryptohan 148（TRP148） of OVA were occupied by tangeretin after the docking, which means tangeretin may have some inhibition effects. As the results of animal experiments, the amount of IgE and lung tissue sections of female BALB/c mice in different groups show that tangeretin with different concentrations has better effects than dexamethasone. In conclusion, the tangeretin may have the effects to reduce the allergic effects of OVA via occupying the IgE-binding epitopes of OVA.

关键词： Tangeretin Ovalbumin Interaction Epitope Conformation

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Discovering Dependence across Traffic Data of Disparate Regions Using Multiscale Generalized Correlation 2018

Discovering Dependence across Traffic Data of Disparate Regi...

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6th International Conference on Information Technology - IoT and Smart City (ICIT)

作者： Qiu, Dehong Zhang, Pin Fang, Shaohong Lang, xuwen feng, Hao Huazhong Univ Sci & Technol Sch Software Engn Wuhan Hubei Peoples R China Wuhan Coll Sch Informat Engn Wuhan Hubei Peoples R China

ISBN: (纸本)9781450366298

Deciphering potential associations between the traffic data of disparate regions is of great importance to urban traffic management. However, as the traffic data is structured, temporal and often high-dimensional, many traditional dependence testing approaches are not directly applicable. In this paper, we propose a new approach to test dependence between traffic data of disparate regions based on distance Correlation (dCorr) and Multiscale Generalized Correlation (MGC). The distance matrix between the structured traffic data of disparate regions is defined, which yields a consistent test statistic for testing dependence of traffic data. We conduct experiments on the real and simulated datasets. The results of our experiments demonstrate that the new approach can capture the complex dependence between the structured traffic data of disparate regions. Simultaneously, it requires a small number of samples and is computationally efficient.

关键词： Traffic management network dependence graph distance distance correlation multiscale generalized correlation

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In-Situ Transformed Ni, S-Codoped CoO from Amorphous Co-Ni Sulfide as an Efficient Electrocatalyst for Hydrogen Evolution in Alkaline Media

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ACS SUSTAINABLE CHEMISTRY & ENGINEERING 2019年第14期7卷 12501-12509页

作者： Lu, Wangting Li, xuwen Wei, feng Cheng, Kun Li, Wenhui Zhou, Youhua Zheng, Wanquan Pan, Lei Zhang, Geng Jianghan Univ Inst Interdisciplinary Res 8 Sanjiaohu Rd Wuhan 430056 Hubei Peoples R China Jianghan Univ Sch Chem & Environm Engn 8 Sanjiaohu Rd Wuhan 430056 Hubei Peoples R China Univ Paris Saclay Univ Paris Sud CNRS Inst Sci Mol Orsay F-91405 Orsay France Jianghan Univ Sch Life Sci 8 Sanjiaohu Rd Wuhan 430056 Hubei Peoples R China Huazhong Agr Univ Coll Sci Dept Chem 1 Shizishan St Wuhan 430070 Peoples R China

Amorphous materials have recently received much attention as catalysts for electrochemical reactions. However, there are relatively few reports focused on the structure change of amorphous catalysts during the catalysis process, although this is quite important to the identification of active species and in revealing the reaction mechanism. Herein, amorphous Co-Ni sulfide in the form of a nanoplate and nanowire hybrid on the surface of nickel foam is prepared as the electrode for the hydrogen evolution reaction (HER). During the hydrogen evolution process, the amorphous Co-Ni sulfide is in-situ transformed into crystalline Ni, S-co-doped CoO which is actually responsible for the catalysis of HER The transformation process is studied in detail by high-resolution transmission electron microscopy (HRTEM), X-ray photoelectron spectroscopy (XPS), and theoretical calculations. The in-situ formed electrode presents a high activity and durability toward HER in alkaline media. The Ni and S dopants, sulfurization temperature, and electrode substrate are revealed to be important factors that affect the activity. The present work will not only give more insights in the structure evolution of the electrocatalyst during HER but also provides a new strategy to the fabrication of new electrocatalysts.

关键词： Water splitting HER Amorphous material Oxide Doping

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Fast sulfurization of nickel foam-supported nickel-cobalt carbonate hydroxide nanowire array at room temperature for hydrogen evolution electrocatalysis

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ELECTROCHIMICA ACTA 2019年 318卷 252-261页

作者： Lu, Wangting Li, xuwen Wei, feng Cheng, Kun Li, Wenhui Zhou, Youhua Zheng, Wanquan Pan, Lei Zhang, Geng Jianghan Univ Inst Interdisciplinary Res Wuhan 430056 Hubei Peoples R China Jianghan Univ Sch Chem & Environm Engn Wuhan 430056 Hubei Peoples R China Univ Paris Saclay Univ Paris Sud Inst Sci Mol Orsay CNRS F-91405 Orsay France Jianghan Univ Sch Life Sci Wuhan 430056 Hubei Peoples R China Huazhong Agr Univ Coll Sci Dept Chem Wuhan 430070 Hubei Peoples R China

Transition metal sulfide is considered as a kind of promising noble metal-free material for hydrogen evolution reaction (HER). However, most of conventional sulfurization methods require high temperature and/or long reaction time. Herein, a sulfurization strategy at room temperature (25 degrees C) by using Na2S in aqueous solution is applied to sulfurize nickel foam-supported nickel-cobalt carbonate hydroxide nanowire array, during which amorphous sulfide gradually forms on the surface of nanowire and finally replaces the nanowire completely. It is found that the electrode sulfurized for 5 min in which only a thin sulfide layer is formed presents nearly identical catalytic performance for HER with the electrode that is sufficiently sulfurized for 120 min. The electrode sulfurized at 25 degrees C for 5 min only needs an overpotential of 100 mV to achieve hydrogen evolution current at 10 mA cm(-2) in 1 M KOH, and negligible loss of activity is observed after working at a current density of 20 mA cm(-2) for 25 h. The interface between carbonate hydroxide and sulfide is considered to play an important role in the catalysis of HER. The observation in this work can provide new insights into the sulfurization process and the role of sulfide in the process of HER. (C) 2019 Elsevier Ltd. All rights reserved.

关键词： HER Sulfide Amorphous Interface DFT

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Development of a Synthesis Process for a Novel HCV NS5A Inhibitor, Emitasvir

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ORGANIC PROCESS RESEARCH & DEVELOPMENT 2021年第4期25卷 838-848页

作者： Xie, Hongming Liu, Haiwang Zhang, Yingjun Huang, Enhuo feng, Yahui Xiang, xuwen Fang, Qinghong Peng, Zhihong Dong, Wanrong An, Delie Hunan Univ Coll Chem & Chem Engn State Key Lab Chemo Biosensing & Chemometr Changsha 410082 Hunan Peoples R China Sunshine Lake Pharma Co Ltd State Key Lab Antiinfect Drug Dev 2015DQ780357 Dongguan 523871 Peoples R China HEC Pharm Grp HEC Res & Dev Ctr Dongguan 523871 Peoples R China

A new approach to the synthesis of Emitasvir (DAG181), a small molecule hepatitis C virus (HCV) nonstructural protein 5A (NS5A) inhibitor, is described. Enantioselective enzymatic desymmetrization with hydrolases in the synthetical approach can significantly avoid the loss of chiral raw materials in the resolution process. The synthesis route is further optimized and scaled-up to establish a new process that is applied to the preparation of kilogram scales of target active pharmaceutical ingredients (APIs). Compared with our initial process, the overall yield of target API was dramatically improved from 17 to 40%.

关键词： hepatitis C virus inhibitor Emitasvir enantioselective synthesis process development

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Strong positive allosteric cooperativity in ternary complexes based on hydrogen-bonded aromatic amide macrocycles

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CHEMICAL COMMUNICATIONS 2019年第33期55卷 4869-4872页

作者： Peng, Zhiyong Guo, xuwen Xu, Weitao Li, Jian Deng, Pengchi Xiao, Xin feng, Wen Yuan, Lihua Sichuan Univ Analyt & Testing Ctr Minist Educ Coll ChemKey Lab Radiat Phys & Technol Chengdu 610064 Sichuan Peoples R China Guizhou Univ Key Lab Macrocycl & Supramol Chem Guizhou Prov Guiyang 550025 Guizhou Peoples R China

Three new hydrogen-bonded aromatic amide macrocycles with eight residues were synthesized. The first single crystal structure of this class of larger macrocycles was obtained, which reveals a saddle-like conformation. Interestingly, in sharp contrast to previous negative cooperativity in binding paraquat with cyclo[6]aramide, strong positive allosteric cooperativity in ternary complexes was observed. This may open an avenue for the construction of mechanically interlocked molecules with these larger H-bonded macrocycles.

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Steroidal saponins from Allium chinense and their inhibitory effects on pancreatic lipase

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PHYTOCHEMISTRY LETTERS 2023年第1期55卷 22-29页

作者： Xie, Huili Shi, Xiaolei Wang, Bingzi Zhao, Dexin Sun, Zhiheng Chen, Yifu feng, Yuezhu Jin, Yongri Li, xuwen Jilin Univ Coll Chem Changchun 130012 Peoples R China Jilin Univ Coll Food Sci & Engn Changchun 130062 Peoples R China

Allium chinense *** is an important medicinal and edible homologous plant and indigenous to China and grown in other countries. Phytochemical studies have shown that it is rich in biologically active natural products. Herein, five new and twelve known steroidal saponins were isolated from the bulbs of Allium chinense ***. These compounds were structurally determined by analysis of their NMR, IR and HR-ESI-MS data. All isolates were evaluated for inhibition of porcine pancreatic lipase activity. Compounds 4, 7 and 10 exhibited potent inhibition of porcine pancreatic lipase. The relationship between structure and activity of these compounds is also investigated in this paper.

关键词： Allium chinense Steroidal saponins Extraction and isolation Structure identification Lipase inhibitory activity

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Deep Reinforcement Learning Home Energy Management Based Local Energy Trading in a Blockchain Platform 9

Deep Reinforcement Learning Home Energy Management Based Loc...

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9th Asia Conference on Power and Electrical Engineering, ACPEE 2024

作者： Jiang, Yu feng, Yingchun Fan, Jie Gao, Bo Wang, Yang Liu, xuwen Jiangsu Electric Power Trading Center State Grid Jiangsu Electric Power Co. LTD Nanjing China

ISBN: (纸本)9798350309638

Decentralized peer-to-peer Local Energy Markets (LEMs) are gaining popularity as local power production from Renewable Energy Sources (RESs) increases. The study investigates a blockchain-driven LEM in which prosumers and consumers buy and sell energy independently of the involvement of a third party. The suggested scheme involves Home Energy Management (HEM) and demurrage mechanisms that enable both consumers and prosumers to reduce their power prices and improve their power usage. The end-user can likewise move the load to off-peak periods and benefit from lower energy costs from the LEM through the approach. In this solution, HEM and demurrage mechanisms are used to optimize power usage as well as energy costs. As well as providing adequate power for the LEM, it is economically beneficial for end users and the community. The proposed system in the study utilizes the Deep Deterministic Policy Gradient (DDPG) algorithm and demurrage mechanisms to optimize electricity usage and energy costs. Meanwhile, smart contract on the Ethereum blockchain regulate and safeguard the electricity trading process. © 2024 IEEE.

关键词： Blockchain

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Improved Eagle Perching Optimizer Based P2P Energy Trading for Smart Homes 9

Improved Eagle Perching Optimizer Based P2P Energy Trading f...

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9th Asia Conference on Power and Electrical Engineering, ACPEE 2024

作者： Jiang, Yu feng, Yingchun Fan, Jie Gao, Bo Wang, Yang Liu, xuwen State Grid Jiangsu Electric Power Co. LTD Jiangsu Electric Power Trading Center Nanjing China

ISBN: (纸本)9798350309638

The purpose of the study is to optimize power price in smart homes that connect to share energy. A Demand Side Management (DSM) system is used to coordinate P2P energy trading between smart homes using the improved eagle perching optimizer (IEPO). The IEPO algorithm produces optimum solutions for 99% of actual datasets, according to the outcomes. It is possible that consumer price distribution in the microgrid (MG) could be unequal as a result of P2P energy trading. The Pareto optimality principle addresses the issue of unequal price distribution, preventing households from being harmed by improving the costs of others. A final evaluation is performed on the effect of renewable energy and the penetration of storage within the MG. As the renewable energy and the penetration of storage increases, savings cannot necessarily be linear. As the saturation point approaches, they slowly begin to decline. © 2024 IEEE.

关键词： Demand side management

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