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Analysis of the mechanism of Zangjiangzhi capsule in the treatment of hyperlipidemia based on its ingredients identified by UHPLC-Q-Exactive-Orbitrap-MS
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作者 Changting He yuling zhao +2 位作者 Yongchun Huang Yudong Su Shoude Zhang 《Journal of Traditional Chinese Medical Sciences》 2025年第1期44-55,共12页
Objective:To explore the mechanism of action of Zangjiangzhi capsule(ZJZC)in treating hyperlipidemia(HLP).Methods:The components of ZJZC were analyzed and identified using ultra-high performance liquid chromatography ... Objective:To explore the mechanism of action of Zangjiangzhi capsule(ZJZC)in treating hyperlipidemia(HLP).Methods:The components of ZJZC were analyzed and identified using ultra-high performance liquid chromatography with Q-Exactive Orbitrap tandem mass spectrometry(UHPLC-Q-Exactive-Orbitrap-MS/MS).Network pharmacology analysis was used to explore the mechanism of action of ZJZC in HLP treatment.The SwissTargetPrediction database was used to predict compound targets,and GeneCards,DisGeNet,OMIM,and DRUGBANK databases were used to identify HLP-related targets.Proteineprotein interaction diagrams were constructed using the STRING database.The targets were subjected to gene ontology and Kyoto Encyclopedia of Genes and Genomes(KEGG)enrichment analysis.The“herbingredient-target”network was visualized using Cytoscape.Preliminary validation was performed using molecular docking and enzyme-linked immunosorbent assay.Results:Ninety compounds were identified in ZJZC,including 34 flavonoids,12 phenols,10 terpenoids,10 alkaloids,8 organic acids,8 anthraquinones,and 9 other compounds.In total,904 targets were identified for these compounds.Among them,158 targets intersected with the HLP target network.Network pharmacology analysis showed that MAPK1,PPAR-a,RXRA,HSP90AA1,PIK3R1,AKT1,PIK3CA,IL6,TNF,and ESR1 are the key targets of action.KEGG enrichment analysis identified 164 pathways.Among these,the AGE-RAGE signaling pathway in diabetic complications,lipid and atherosclerosis pathways,regulation of lipids in adipocytes,and insulin resistance are related to HLP.Molecular docking showed good affinity between the key targets and ingredients.Further,ZJZC treatment in mice resulted in lower expression of MAPK1 protein and increased expression of PPAR-a protein,which have been shown to be strongly associated with HLP.Conclusions:This study showed that ZJZC contains various active ingredients and can modulate multiple targets and pathways associated with HLP,providing evidence at the molecular level for its clinical application in the treatment of HLP. 展开更多
关键词 Zangjiangzhi capsule HYPERLIPIDEMIA UHPLC-MS/MS Network pharmacology Molecular docking Enzyme-linked immunosorbent assay
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Boosting the cycling stability of all-solid-state lithium metal batteries through MOF-based polymeric protective layers
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作者 Hongfei Bao Diancheng Chen +9 位作者 Jiaqi Cao Pengfeng Jiang Kaili Li Runtao Liu yuling zhao Yichun Zheng Beiqi Liao Yaming Zhang Xia Lu Yang Sun 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2024年第8期511-518,I0011,共9页
Solid-state electrolytes(SSEs)play a pivotal role in advancing next-generation lithium metal battery technology.However,they commonly encounter substantial interfacial resistance and poor stability when interfacing wi... Solid-state electrolytes(SSEs)play a pivotal role in advancing next-generation lithium metal battery technology.However,they commonly encounter substantial interfacial resistance and poor stability when interfacing with lithium metal,hindering practical applications.Herein,we introduce a flexible metal-organic framework(MOF:NUS-6)-incorporated polymeric layer,denoted as NP,designed to protect the sodium superionic conductor(NASICON)-type Li_(1.3)Al_(0.3)Ti_(1.7)(PO_(4))_(3)(LATP)electrolyte from Li metal anodes.The NP matrix establishes a soft interface with the LATP surface,effectively reducing voids and gaps that may arise between the LATP electrolyte and Li metal.Moreover,the MOF component in NP enhances ionic conductivity,offers abundant Li^(+)transport sites,and provides hierarchical ion channels,ensuring a homogeneous Li^(+)flow and thus effectively inhibiting Li dendrite formation.Utilizing NP,we fabricate Li symmetrical cells cycled for over 1600 h at 0.2 mA cm^(-2)and all-solid-state LiINP-LATPI LiFePO_(4)batteries,achieving a remarkable 99.3%capacity retention after 200 cycles at 0.2 C.This work outlines a general strategy for designing long-lasting and stable solid-state Li metal batteries. 展开更多
关键词 All-solid-state Li metal battery MOF-based polymeric layer Li dendrite Interfacial contact LATP electrolyte stability
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Anionic structural effect in liquid–liquid separation of phenol from model oil by choline carboxylate ionic liquids 被引量:8
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作者 Zhiyong Li Ruipeng Li +4 位作者 Xiaoqing Yuan Yuanchao Pei yuling zhao Huiyong Wang Jianji Wang 《Green Energy & Environment》 CSCD 2019年第2期131-138,共8页
Phenolic compounds exist in crude oil as pollutants, and their removal is vital important for the refining and further application of oils. In traditional separation approaches, strong acid and strong base have to be ... Phenolic compounds exist in crude oil as pollutants, and their removal is vital important for the refining and further application of oils. In traditional separation approaches, strong acid and strong base have to be used to remove these compounds, which may cause serious environmental problems. In this work, 19 kinds of cholinium ionic liquids have been developed to separate phenol from model oil by liquid–liquid extraction. Structural effect of anions of the ionic liquids in the separation is systematically investigated. It is found that depending on the chemical structure of ionic liquids, phenol can be removed from toluene with single-step removal efficiency from 86 to 99% under optimal conditions. The type of substituent groups and the-CH_2 number between two carboxylates have obvious effect on the removal efficiency, and more hydrophilic ionic liquids have a stronger extraction performance for phenol. Furthermore, thermodynamic,^(13) C NMR,~1 H NMR and density functional theory calculations have been performed to characterize the extraction process and to understand the extraction mechanism. It is shown that the extraction of phenol from oil to ionic liquid is a favorable process, and this process is mainly driven by enthalpy change. The formation of the hydrogen bond between anion of the ionic liquid and-OH of phenol is the main driving force for the extraction of phenol from oil to the ionic liquids. 展开更多
关键词 Ionic LIQUID Extraction PHENOL CHOLINE Hydrogen bonding
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光响应离子液体的结构与性能调控 被引量:3
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作者 李志勇 冯莹 +3 位作者 王慧勇 袁晓晴 赵玉灵 王键吉 《化学进展》 SCIE CAS CSCD 北大核心 2019年第11期1550-1559,共10页
光响应离子液体是一类兼具光刺激响应和离子液体双重特性的功能材料。在紫外/可见光照下,这类“智能型”离子液体的结构会发生变化,从而引起物理化学性质和相关体系性能的显著变化,以满足某些特定过程的需要。光刺激具有信号稳定、刺激... 光响应离子液体是一类兼具光刺激响应和离子液体双重特性的功能材料。在紫外/可见光照下,这类“智能型”离子液体的结构会发生变化,从而引起物理化学性质和相关体系性能的显著变化,以满足某些特定过程的需要。光刺激具有信号稳定、刺激部位精准、可快速切换、刺激过程不引入其他物质等优点,在刺激响应离子液体的结构与性质调控中具有独特的优势。本文以光响应离子液体的结构-性质-性能关系为主线,对光响应离子液体的光致异构化、物理化学性质调制、簇集行为调控、光致相转移及离子液体参与构筑的光响应乳液相行为调控等方面的研究进展进行了评述,分析了该领域研究中存在的主要问题,并对其发展前景进行了展望。 展开更多
关键词 离子液体 光响应 光致异构 性能调控
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Boosting Li-ion storage in Li2MnO_(3) by unequal-valent Ti4+-substitution and interlayer Li vacancies building 被引量:1
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作者 Yu Tian yuling zhao +9 位作者 Fanqi Meng Kaicheng Zhang Yanyuan Qi Yujie Zeng Congcong Cai Yuli Xiong Zelang Jian Yang Sun Lin Gu Wen Chena 《Chinese Chemical Letters》 SCIE CAS CSCD 2023年第4期564-569,共6页
Lithium rich layered oxide(LRLO) has been considered as one of the promising cathodes for lithium-ion batteries(LIBs). The high voltage and large capacity of LRLO depend on Li2MnO_(3)phase. To ameliorate the electroch... Lithium rich layered oxide(LRLO) has been considered as one of the promising cathodes for lithium-ion batteries(LIBs). The high voltage and large capacity of LRLO depend on Li2MnO_(3)phase. To ameliorate the electrochemical performance of Li2MnO_(3), also written as Li(Li1/3Mn2/3)O_(2), we propose a strategy to substitute Mn4+and Li+in Mn/Li transition metal layer with Ti4+, which can stabilize the structure of Li2MnO_(3)by inhibiting the excessive oxidation of O_(2)-above 4.5 V. More significantly, the unequal-valent substitution brings about the emergence of interlayer Li vacancies, which can promote the Li-ion diffusion based on the enlarged interlayer and increase the capacity by activating the Mn3+/4+redox. We designed Li0.7[Li1/3Mn2/3]0.7Ti0.3O_(2)with high interlayer Li vacancies, which presents a high capacity(290 m Ah/g at 10 m A/g) and stable cycling performance(84% over 60 cycles at 50 m A/g). We predict that this strategy will be helpful to further improve the electrochemical performance of LRLOs. 展开更多
关键词 Lithium-ion batteries Li2MnO_(3) Unequal-valent Ti4+-substitution Interlayer Li vacancies Activated Mn3+/4+redox
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Diverse Teaching Methods of Modem University Teachers
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作者 yuling zhao Zhuo Zhang Ruike Cui 《International Journal of Technology Management》 2013年第11期1-2,共2页
With the rapid development of modem teaching technology, teaching equipment in university has been greatly changed. Some university classrooms have been equipped with modem multimedia classrooms, computers, printers, ... With the rapid development of modem teaching technology, teaching equipment in university has been greatly changed. Some university classrooms have been equipped with modem multimedia classrooms, computers, printers, scanners, recorders, projectors, digital cameras and other advanced electrical teaching equipment; which encourage teachers to collect and accumulate example materials and make auxiliary teaching of multimedia courseware. The teaching methods of pictures, texts, sound, dynamics and colors make the original boring teaching content, which is difficult to understand, become intuitive, vivid and easy to understand. It promotes students' positive thinking and stimulates students' potential, so as to greatly improve students' leaming enthusiasm. 展开更多
关键词 teaching methods diverse stimulate POTENTIAL
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Importance of Nurses' Clothes Etiquette in Medical Education
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作者 yuling zhao Zhuo Zhang Ruike Cui 《International Journal of Technology Management》 2013年第12期134-136,共3页
Good clothes etiquette of nurses can meet the mental needs of patients, which can promote early recovery of patients. A nurse with a good clothes etiquette style conveys the information to the patients, which can prod... Good clothes etiquette of nurses can meet the mental needs of patients, which can promote early recovery of patients. A nurse with a good clothes etiquette style conveys the information to the patients, which can produce a positive effect, so nurses' appropriate clothes appearance, proper manners, kind and amiable attitude and appropriate discourse and other good clothes etiquettes can achieve the effect that the medicine can not achieve. 展开更多
关键词 nurses CLOTHES ETIQUETTE INFLUENCE
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Gorgeous Transformation Analysis on Influence of Doctors' Clothes on Patients
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作者 yuling zhao Zhuo Zhang Ruike Cui 《International Journal of Technology Management》 2013年第11期121-122,共2页
Doctors' clothes have bidden farewell to the historical limitation of only being used as the working clothes, which have become an important part of hospital image. In the eyes of patients, the appearance image of do... Doctors' clothes have bidden farewell to the historical limitation of only being used as the working clothes, which have become an important part of hospital image. In the eyes of patients, the appearance image of doctors is the image which is most concerned by patients. Doctors' clothes beauty reflects the inner beauty of doctors in working, giving the patients the warmth and comfort, which is of great importance to both the physical and mental therapy. 展开更多
关键词 DOCTORS CLOTHES PATIENTS INFLUENCE
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Innovation-- Quality and Knowledge Structure that Modem University Teachers Must Have
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作者 yuling zhao Zhuo Zhang Ruike Cui 《International Journal of Technology Management》 2013年第12期46-47,共2页
The teaching of university teachers is no longer a transfer activity of "teachers teaching students listening" , but to constantly have innovative teaching methods, teaching environment and teaching philosophy; so a... The teaching of university teachers is no longer a transfer activity of "teachers teaching students listening" , but to constantly have innovative teaching methods, teaching environment and teaching philosophy; so as to arouse students' "enthusiasm for knowledge" , making students enthusiastically seek for knowledge under the support of "knowledge interest" and "knowledge belief" . 展开更多
关键词 INNOVATION PROGRESS development
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失眠症的护理中起居护理的重要性
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作者 赵玉玲 《中国蒙医药(蒙)》 2023年第1期150-153,共4页
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Bifunctional noble-metal-free cocatalyst coating enabling better coupling of photocatalytic CO_(2)reduction and H_(2)O oxidation on direct Z-scheme heterojunction 被引量:1
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作者 Wei zhao Weihao Mo +8 位作者 Yan Zhang Lingxuan Hu Yiyi Zheng Zhulei Chen Xiangyue Niu yuling zhao Lichun Liu Shuxian Zhong Song Bai 《Nano Research》 SCIE EI CSCD 2024年第6期5022-5030,共9页
Selective loading of spatially separated redox cocatalysts on direct Z-scheme heterojunctions holds great promise for advancing the efficiency of artificial photosynthesis,which however is limited to the photodepositi... Selective loading of spatially separated redox cocatalysts on direct Z-scheme heterojunctions holds great promise for advancing the efficiency of artificial photosynthesis,which however is limited to the photodeposition of noble metal cocatalysts and the fabrication of hollow double-shelled semiconductor heterojunctions.Moreover,the co-exposure of discrete cocatalyst and semiconductor increases the product diversity when both the exposed sites of which participate in CO_(2)photoreduction.Herein,we present a facile and versatile protocol to overcome these limitations via surface coating of Z-scheme heterojunctions with bifunctional noble-metal-free cocatalysts.With Cu_(2)O/Fe_(2)O_(3)(CF)as a model heterojunction and layered Ni(OH)_(2)as a model cocatalyst,it is found that Ni(OH)_(2)lying on the surfaces of Cu_(2)O and Fe_(2)O_(3)separately co-catalyzes the CO_(2)reduction and H_(2)O oxidation.Thorough experimental and theoretical investigation reveals that the Ni(OH)_(2)outer layer:(i)mitigates the charge recombination in CF and balances their transfer and consumption;(ii)reduces the rate-determining barriers for CO_(2)-to-CO and H_(2)O-to-O_(2)conversion,(iii)suppresses the side proton reduction occurring on CF,and(iv)protects the CF from component detachment.As expected,the redox reactions stoichiometrically proceed,and significantly enhanced photocatalytic activity,selectivity,and stability in CO generation are achieved by the stacked Cu_(2)O/Fe_(2)O_(3)@Ni(OH)_(2)in contrast to CF.This study demonstrates the significance of the synergy between bifunctional cocatalysts and Z-scheme heterojunctions for improving the efficacy of overall redox reactions,opening a fresh avenue for the rational design of artificial photosynthetic systems. 展开更多
关键词 Z-scheme heterojunction bifunctional cocatalyst CO_(2)reduction H_(2)O oxidation stoichiometric redox reaction
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Themechanism of resistance to CDK4/6 inhibition and novel combination therapy with RNR inhibition for chemo-resistant bladder cancer 被引量:1
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作者 Zhichao Tong Yubo zhao +11 位作者 Shiyu Bai Benedikt Ebner Lou Lienhard yuling zhao Ziqi Wang Qi Pan Pengyu Guo Thilo Bracht Barbara Sitek Jürgen E.Gschwend Wanhai Xu Roman Nawroth 《Cancer Communications》 SCIE 2024年第6期700-704,共5页
Bladder cancer(BCa)is the most prevalent urological cancer worldwide[1].A significant proportion of BCa(89%)exhibits molecular alterations in the cell cycle pathway,and targeting cyclin-dependent kinases 4 and 6(CDK4/... Bladder cancer(BCa)is the most prevalent urological cancer worldwide[1].A significant proportion of BCa(89%)exhibits molecular alterations in the cell cycle pathway,and targeting cyclin-dependent kinases 4 and 6(CDK4/6)is deemed as a promising therapeutic strategy[2].Selective inhibitors of CDK4/6(CDK4/6is)have been approved by the US Food and Drug Administration(FDA)[3]. 展开更多
关键词 BLADDER CDK4 alterations
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离子液体微乳液研究进展
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作者 裴渊超 牛亚娟 +4 位作者 张婉军 李志勇 王慧勇 赵玉灵 王键吉 《中国科学:化学》 CAS CSCD 北大核心 2020年第2期211-222,共12页
离子液体参与构筑的微乳液体系兼顾了离子液体和微乳液的优点,如热稳定范围宽、增溶能力强、结构/性质可调控等.根据离子液体的结构特点,它可以替代经典微乳液中的任意一个组分形成离子液体微乳液,并在材料制备、酶活性和生物催化、药... 离子液体参与构筑的微乳液体系兼顾了离子液体和微乳液的优点,如热稳定范围宽、增溶能力强、结构/性质可调控等.根据离子液体的结构特点,它可以替代经典微乳液中的任意一个组分形成离子液体微乳液,并在材料制备、酶活性和生物催化、药物增溶与传输等领域展示了良好的应用前景.本文系统地总结了离子液体替代经典微乳液中的一个组分、两个组分和三个组分所形成的离子液体微乳液,综述了这类体系的结构、性质、应用等方面的研究进展,并对其未来发展趋势和需要解决的主要问题进行了分析讨论. 展开更多
关键词 离子液体 微乳液 自组装 微结构 纳米反应器
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Deconstructing Amorphous MoS_(2)-Crystalline Ni_(3)S_(2)Heterostructures Toward High-Performance Alkaline Water Splitting
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作者 Yu Zhang Libo Zheng +13 位作者 Xinyu Yang Mingyue Xu Pengfei Gao Jun Yang Waheed S.Khan Jianhua Hou Liangyun Zhai Shengjie Zhu yuling zhao Peng Zhou Hui Zhang Xilan Ma Zhuo Chen Junyu Zhong 《Carbon Energy》 2025年第10期151-161,共11页
Developing low-cost and efficient catalysts for sustainable hydrogen(H2)production to the reliance on precious metal is an important trend in the future development of catalysts.Herein,a simple in-situ one-step hydrot... Developing low-cost and efficient catalysts for sustainable hydrogen(H2)production to the reliance on precious metal is an important trend in the future development of catalysts.Herein,a simple in-situ one-step hydrothermal strategy is employed to modify the outer layer of Ni_(3)S_(2)crystals with amorphous MoS_(2)to construct core-shell heterostructures and heterogeneous interfaces,which promotes the chemisorption of intermediates,including hydrogen and oxygen,and realizes the coupling enhancement of hydrogen-evolution reaction(HER)and oxygen-evolution reaction(OER)in alkaline water electrolysis process.In 1.0 M KOH electrolyte,the overpotentials of the electrodes are 78 mV(HER)and 245 mV(OER)at a current density of 10 mA cm^(−2),respectively.At the same time,the electrode has excellent stability for more than 100 h at a current density of 100 mA cm^(−2),due to the amorphous structure.In addition,when used as an anode and cathode to form an electrolyzer,a cell voltage of only 1.5 V is required to produce a current density of 10 mA cm^(−2).This study demonstrates that the constructed amorphous heterostructured interface synergistically promotes the dissociation of water and the adsorption of intermediates,providing a deep insight on how to accelerate the development of efficient catalysts. 展开更多
关键词 electrocatalyst heterogeneous interface hydrogen‐evolution reaction oxygen‐evolution reaction water splitting
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溶液中离子液体有序聚集体微观结构的分子动力学模拟研究进展
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作者 赵玉灵 万文亮 +5 位作者 仇记宽 李志勇 王慧勇 裴渊超 赵扬 王键吉 《中国科学:化学》 CAS CSCD 北大核心 2021年第10期1406-1414,共9页
具有两亲结构的离子液体在溶液中可以形成各种不同类型的有序分子聚集体,这些聚集体作为微反应器或模板在化学、化工、材料、资源、环境等领域具有重要的应用前景.因此,深入研究溶液中有序聚集体的微观结构具有重要意义.分子动力学模拟... 具有两亲结构的离子液体在溶液中可以形成各种不同类型的有序分子聚集体,这些聚集体作为微反应器或模板在化学、化工、材料、资源、环境等领域具有重要的应用前景.因此,深入研究溶液中有序聚集体的微观结构具有重要意义.分子动力学模拟是研究离子液体有序分子聚集体微观结构和相互作用的重要手段.本文综述了近年来分子动力学模拟技术在研究离子液体有序聚集体微观结构方面的研究进展,系统总结了胶束、囊泡、溶致液晶等有序聚集体的微观结构及形成机理,并对其未来发展趋势和需要解决的主要问题进行了分析. 展开更多
关键词 离子液体 有序聚集体 微观结构 分子动力学模拟
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The “1-3-7” Approach to Malaria Surveillance and Response--Henan Province, China, 2012−2018 被引量:5
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作者 Qunqun Zhang Ying Liu +9 位作者 Yabo Hu yuling zhao Chengyun Yang Dan Qian Ruimin Zhou Suhua Li Zhou Guan Deling Lu Hongwei Zhang Wanshen Guo 《China CDC weekly》 2020年第17期289-292,共4页
What is already known about this topic?The“1-3-7”approach to malaria surveillance and response was a key measure for malaria elimination in China and was first introduced into the World Health Organization(WHO)as an... What is already known about this topic?The“1-3-7”approach to malaria surveillance and response was a key measure for malaria elimination in China and was first introduced into the World Health Organization(WHO)as an international guideline for malaria surveillance and response in 2018.What is added by this report?The“1-3-7”approach was well implemented in Henan Province from 2012−2018.Over this study period,a total of 1,294 malaria cases were detected and reported,and all cases were diagnosed and reported within 1 day with 99.23%(1,284/1,294)of cases were investigated within 3 days.In addition,93.7%(1,212/1,294)of foci were investigated and vector control was implemented within 7 days at all residual non-active foci to prevent further spread.What are the implications for public health practice?The“1-3-7”controlling pattern would be an effective and approachable method for implementation especially in malaria-eliminating countries and regions,but the interval from symptom onset to diagnosis cannot be ignored.Thus,the roles and responsibilities that all actors involved in the health sector must be specified too. 展开更多
关键词 HENAN specified eliminating
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Tunable LCST-type phase behavior of [FeCl4]--based ionic liquids in water 被引量:1
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作者 Yuanchao Pei Yuan Cao +4 位作者 Yanjie Huang Xinxin Song Huiyong Wang yuling zhao Jianji Wang 《Science China Chemistry》 SCIE EI CAS CSCD 2016年第5期587-593,共7页
In this work, 16 kinds of [FeCl4]--based magnetic ionic liquids (ILs) with different cation structures have been designed and synthesized, and their structures are characterized by IR and Raman spectroscopy. Then th... In this work, 16 kinds of [FeCl4]--based magnetic ionic liquids (ILs) with different cation structures have been designed and synthesized, and their structures are characterized by IR and Raman spectroscopy. Then the lower critical solution temperature (LCST)-type phase behavior of these magnetic ILs in water is investigated as a function of concentration. It is shown that cat- ion structure, alkyl chain length and molar ratio of FeCl3/chloride IL have a significant influence on the LCST of the mixtures. The phase separation temperature can be tuned efficiently by these factors. Meanwhile, the LCST-type phase separation pro- cess is also investigated by dynamic light scattering. The results support the mechanism that the hydrogen bonds of the [Fefl4]- anion with water have been gradually disrupted to form ILs aggregates with increasing temperature. In addition, the stability of the ILs in water is also examined in some details. These LCST-type phase separation systems may have potential applications in extraction and separation techniques at room temperature. 展开更多
关键词 magnetic ionic liquids IR and Raman spectroscopy lower critical solution temperature tunable phase separation
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1-乙基-3-甲基咪唑甘氨酸离子液体与水的相互作用研究 被引量:1
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作者 闵照军 李志勇 +4 位作者 赵玉灵 王慧勇 轩小朋 赵扬 王键吉 《中国科学:化学》 CAS CSCD 北大核心 2022年第5期743-751,共9页
氨基酸离子液体因具有生物相容性、可降解性和易于合成等特点,在许多领域具有重要的应用前景.由于不同程度的吸湿性,水对氨基酸离子液体的结构和性质的影响不可忽略,因此深入研究氨基酸离子液体的微观结构及其与水分子间相互作用的本质... 氨基酸离子液体因具有生物相容性、可降解性和易于合成等特点,在许多领域具有重要的应用前景.由于不同程度的吸湿性,水对氨基酸离子液体的结构和性质的影响不可忽略,因此深入研究氨基酸离子液体的微观结构及其与水分子间相互作用的本质具有重要意义.本文以1-乙基-3-甲基咪唑甘氨酸离子液体([C_(2)mim][Gly])为例,通过核磁共振波谱、二维红外光谱、量化计算、分子模拟等手段系统地研究了氨基酸离子液体与水的相互作用.结果表明,在25.0℃时,向[C_(2)mim][Gly]中加入水后,水分子优先与甘氨酸阴离子发生作用,破坏阴阳离子间的氢键.随着水分子数目的增加,部分甘氨酸阴离子水解为甘氨酸分子.当一个[C_(2)mim][Gly]分子周围至少有8个水分子时,阴阳离子间的氢键会被完全破坏,形成溶剂化的自由离子. 展开更多
关键词 氨基酸离子液体 水溶液 氢键 离子溶剂化
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Hydrogen bonding mediated ion pairs of some aprotic ionic liquids and their structural transition in aqueous solution
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作者 Huiyong Wang Miao Liu +3 位作者 yuling zhao Xiaopeng Xuan Yang zhao Jianji Wang 《Science China Chemistry》 SCIE EI CAS CSCD 2017年第7期970-978,共9页
Ion pair speciation of ionic liquids(ILs) has an important effect on the physical and chemical properties of ILs and recognition of the structure of ion pairs in solution is essential. It has been reported that ion pa... Ion pair speciation of ionic liquids(ILs) has an important effect on the physical and chemical properties of ILs and recognition of the structure of ion pairs in solution is essential. It has been reported that ion pairs of some ILs can be formed by hydrogen bonding interactions between cations and anions of them. Considering the fact that far-IR(FIR) spectroscopy is a powerful tool in indicating the intermolecular and intramolecular hydrogen bonding, in this work, this spectroscopic technique has been combined with molecular dynamic(MD) simulation and nuclear magnetic resonance hydrogen spectroscopy(~1H NMR) to investigate ion pairs of aprotic ILs [Bmim][NO_3], [BuPy][NO_3], [Pyr_(14)][NO_3], [PP_(14)][NO_3] and [Bu-choline][NO_3] in aqueous IL mixtures. The FIR spectra have been assigned with the aid of density functional theory(DFT) calculations, and the results are used to understand the effect of cationic nature on the structure of ion pairs. It is found that contact ion pairs formed in the neat aprotic ILs by hydrogen bonding interactions between cation and anion, were still maintained in aqueous solutions up to high water mole fraction(say 0.80 for [BuPy][NO3]). When water content was increased to a critical mole fraction of water(say 0.83 for [BuPy][NO3]), the contact ion pairs could be transformed into solvent-separated ion pairs due to the formation of the hydrogen bonding between ions and water. With the further dilution of the aqueous ILs solution, the solvent-separated ion pairs was finally turned into free cations and free anions(fully hydrated cations or anions). The concentrations of the ILs at which the contact ion pairs were transformed into solvent-separated ion pairs and solvent-separated ion pairs were transformed into free ions(fully hydrated ion) were dependent on the cationic structures. These information provides direct spectral evidence for ion pair structures of the aprotic ILs in aqueous solution. MD simulation and ~1H NMR results support the conclusion drawn from FIR spectra investigations. 展开更多
关键词 ionic liquids ion pair hydrogen bonding far infrared spectroscopy solution
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