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Multi-Objective Image Optimization of Product Appearance Based on Improved NSGA-II 被引量:1
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作者 Yinxue Ao jian lv +1 位作者 Qingsheng Xie Zhengming Zhang 《Computers, Materials & Continua》 SCIE EI 2023年第9期3049-3074,共26页
A second-generation fast Non-dominated Sorting Genetic Algorithm product shape multi-objective imagery optimization model based on degradation(DNSGA-II)strategy is proposed to make the product appearance optimization ... A second-generation fast Non-dominated Sorting Genetic Algorithm product shape multi-objective imagery optimization model based on degradation(DNSGA-II)strategy is proposed to make the product appearance optimization scheme meet the complex emotional needs of users for the product.First,the semantic differential method and K-Means cluster analysis are applied to extract the multi-objective imagery of users;then,the product multidimensional scale analysis is applied to classify the research objects,and again the reference samples are screened by the semantic differentialmethod,and the samples are parametrized in two dimensions by using elliptic Fourier analysis;finally,the fuzzy dynamic evaluation function is used as the objective function of the algorithm,and the coordinates of key points of product contours Finally,with the fuzzy dynamic evaluation function as the objective function of the algorithm and the coordinates of key points of the product profile as the decision variables,the optimal product profile solution set is solved by DNSGA-II.The validity of the model is verified by taking the optimization of the shape scheme of the hospital connection site as an example.For comparison with DNSGA-II,other multi-objective optimization algorithms are also presented.To evaluate the performance of each algorithm,the performance evaluation index values of the five multi-objective optimization algorithms are calculated in this paper.The results show that DNSGA-II is superior in improving individual diversity and has better overall performance. 展开更多
关键词 Product appearance optimization NSGA-II multi-objective optimizations perceptual image semantic differential method
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Gegen Qinlian decoction enhances immunity and protects intestinal barrier function in colorectal cancer patients via gut microbiota 被引量:30
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作者 Yang Li Zhong-Xin Li +6 位作者 Chen-Yang Xie Jing Fan Ji lv Xin-jian Xu jian lv Wen-Tao Kuai Yi-Tao Jia 《World Journal of Gastroenterology》 SCIE CAS 2020年第48期7633-7651,共19页
BACKGROUND We previously showed,using the Traditional Chinese Medicine System Pharmacology Database,that Gegen Qinlian decoction(GQD)had a direct antitumor effect,and was combined with programmed cell death protein(PD... BACKGROUND We previously showed,using the Traditional Chinese Medicine System Pharmacology Database,that Gegen Qinlian decoction(GQD)had a direct antitumor effect,and was combined with programmed cell death protein(PD)-1 inhibitors to treat microsatellite stable(MSS)tumor-bearing mice.However,the effect of GQD on patients with colorectal cancer(CRC)is not clear.AIM To determine the therapeutic mechanism of GQD in improving immune function,reducing inflammation and protecting intestinal barrier function.METHODS Seventy patients with CRC were included in this study:37 in the control group and 33 in the treatment group.The proportions of CD4+T,CD8+T,natural killer(NK),NKT and T regulatory cells were measured by flow cytometry.Levels of the cytokines tumor necrosis factor(TNF)-α,interferon(IFN)-γ,interleukin(IL)-2,IL-6,IL-10 and serotonin(5-hydroxytryptamine;5-HT)in serum were assessed by enzyme-linked immunosorbent assay(ELISA).The expression of zonula occludens(ZO)-1,occludin,nuclear factor(NF)-κB and TNF-αin tumor and normal tissues was measured by immunohistochemistry.The composition of gut microbiota from patients in the treatment group was assessed using 16S rDNA analysis.RESULTS There were no adverse events in the treatment group.The proportion of CD4+T cells and NKT cells in the post-treatment group was significantly higher than that in the pre-treatment and control groups(P<0.05).The level of TNF-αin the posttreatment group was significantly lower than that in the pre-treatment and control groups(P<0.05).The concentration of 5-HT in the post-treatment group was significantly lower than that in the pre-treatment group(P<0.05).The expression of ZO-1 and occludin in tumor tissues in the treatment group was significantly higher than that in the control group(P<0.05).The expression of ZO-1 in normal tissues of the treatment group was significantly higher than that in the control group(P=0.010).Compared with the control group,expression of NF-κB and TNF-αin tumor tissues of the treatment group was significantly decreased(P<0.05).Compared with the pre-treatment group,GQD decreased the relative abundance of Megamonas and Veillonella.In addition,GQD increased the relative abundance of Bacteroides,Akkermansia and Prevotella.CONCLUSION GQD enhances immunity and protects intestinal barrier function in patients with CRC by regulating the composition of gut microbiota. 展开更多
关键词 Colorectal cancer Gegen Qinlian decoction IMMUNITY INFLAMMATION Intestinal barrier function Gut microbiota
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The CALYPSO methodology for structure prediction 被引量:3
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作者 Qunchao Tong jian lv +1 位作者 Pengyue Gao Yanchao Wang 《Chinese Physics B》 SCIE EI CAS CSCD 2019年第10期22-29,共8页
Structure prediction methods have been widely used as a state-of-the-art tool for structure searches and materials discovery, leading to many theory-driven breakthroughs on discoveries of new materials. These methods ... Structure prediction methods have been widely used as a state-of-the-art tool for structure searches and materials discovery, leading to many theory-driven breakthroughs on discoveries of new materials. These methods generally involve the exploration of the potential energy surfaces of materials through various structure sampling techniques and optimization algorithms in conjunction with quantum mechanical calculations. By taking advantage of the general feature of materials potential energy surface and swarm-intelligence-based global optimization algorithms, we have developed the CALYPSO method for structure prediction, which has been widely used in fields as diverse as computational physics, chemistry, and materials science. In this review, we provide the basic theory of the CALYPSO method, placing particular emphasis on the principles of its various structure dealing methods. We also survey the current challenges faced by structure prediction methods and include an outlook on the future developments of CALYPSO in the conclusions. 展开更多
关键词 STRUCTURE PREDICTION CALYPSO method CRYSTAL STRUCTURE POTENTIAL ENERGY surface
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Theory-orientated discovery of high-temperature superconductors in superhydrides stabilized under high pressure 被引量:7
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作者 jian lv Ying Sun +1 位作者 Hanyu Liu Yanming Ma 《Matter and Radiation at Extremes》 SCIE CAS 2020年第6期88-90,共3页
A dream long held by physicists has been to raise the critical temperature(Tc)—the temperature below which the material exhibits no electrical resistance—of a superconductor to room temperature.The most recent excit... A dream long held by physicists has been to raise the critical temperature(Tc)—the temperature below which the material exhibits no electrical resistance—of a superconductor to room temperature.The most recent excitement in that regard has centered on rare-earth superhydrides,of which LaH10 at 190 GPa has a remarkably high Tc of 260 K. 展开更多
关键词 temperature. STABILIZED SUPERCONDUCTORS
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Yolk-Shell Cu_(2)O@CuO-decorated RGO for High-Performance Lithium-Ion Battery Anode 被引量:3
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作者 Fangzhao Pu Yilu Bai +7 位作者 jian lv Xintian Zhao Guanchen Wu Chuncai Kong Bosen Lei Xiaojing Zhang Hong Jin Zhimao Yang 《Energy & Environmental Materials》 SCIE EI CAS CSCD 2022年第1期253-260,共8页
Based on the great advantages of an inner hollow structure and excellent solid counterpart capacity,complex hierarchical structures have been widely used as electrodes for lithium-ion batteries.Herein,hierarchical yol... Based on the great advantages of an inner hollow structure and excellent solid counterpart capacity,complex hierarchical structures have been widely used as electrodes for lithium-ion batteries.Herein,hierarchical yolk-shell Cu_(2)O@Cu O-decorated RGO(YSRs)was designed and synthesized via a multistep approach.Octahedron-like Cu_(2)O-decorated RGO was firstly produced,in which GO was reduced slightly while cuprous oxide was synthesized.Subsequently,the controlled oxidation of Cu_(2)O@RGO led to the synthesis of special YSRs,which were composed of a solid Cu_(2)O core,spur-CuO,CuO shell,and RGO covered.As anode materials,YSRs could provide considerable capacity density.Meanwhile,the void existed between shells and solid active materials retaining the advantages of inner hollow structure.As a result,the unique architecture of the materials renders the composites with enhanced electronic and ionic diffusion kinetics,high specific capacity(~894 m Ah g^(-1),0.1 C),and an excellent rate capability. 展开更多
关键词 copper oxide Cu_(2)O Li-ion battery nanocomposites yolk-shell
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Common iliac artery occlusion with small intestinal transection caused by blunt abdominal trauma: A case report and review of the literature
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作者 You-Xin Zhou Yong Ji +3 位作者 Jing Chen Xin Yang Qing Zhou jian lv 《World Journal of Clinical Cases》 SCIE 2019年第15期2120-2127,共8页
BACKGROUND Most major abdominal vascular injuries are caused by penetrating injuries.A common iliac artery occlusion caused by blunt force trauma is rare,and very few cases have been reported.Because of this low incid... BACKGROUND Most major abdominal vascular injuries are caused by penetrating injuries.A common iliac artery occlusion caused by blunt force trauma is rare,and very few cases have been reported.Because of this low incidence,atypical symptoms,and frequent association with other severe injuries,the proper diagnosis tends to be missed or delayed.The gold standard for diagnosis is angiography,and treatment remains a challenge.CASE SUMMARY We report here the unusual case of a common iliac artery occlusion caused by blunt abdominal compressive trauma,with transection of the small intestine.At presentation,the patient(a 56-year-old man)complained of pain and numbness in the left lower extremity and severe pain in the whole abdomen.Physical examination showed total abdominal tenderness with evidence of peritoneal irritation.The left lower limb was pulseless and cold.Abdominal computed tomography examination revealed digestive tract perforation,and abdominal computed tomography angiography showed left common iliac artery occlusion.The patient was treated successfully by anastomosis of the intestine,percutaneous transluminal angioplasty,and stenting.The patient was followed for more than 11 mo after the operation and showed a good recovery.CONCLUSION Patients with abdominal trauma should be suspected of having major vascular injury.Individualized treatment strategies are needed for this condition. 展开更多
关键词 Common ILIAC artery OCCLUSION TRANSECTION of the small INTESTINE Blunt abdominal trauma Case report Percutaneous TRANSLUMINAL ANGIOPLASTY Anastomosis of the INTESTINE
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Pressure-induced phase transition in transition metal trifluorides
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作者 Peng Liu Meiling Xu +6 位作者 jian lv Pengyue Gao Chengxi Huang Yinwei Li jianyun Wang Yanchao Wang Mi Zhou 《Chinese Physics B》 SCIE EI CAS CSCD 2022年第10期102-106,共5页
As a fundamental thermodynamic variable, pressure can alter the bonding patterns and drive phase transitions leading to the creation of new high-pressure phases with exotic properties that are inaccessible at ambient ... As a fundamental thermodynamic variable, pressure can alter the bonding patterns and drive phase transitions leading to the creation of new high-pressure phases with exotic properties that are inaccessible at ambient pressure. Using the swarm intelligence structural prediction method, the phase transition of TiF_(3), from R-3c to the Pnma phase, was predicted at high pressure, accompanied by the destruction of TiF_6 octahedra and formation of TiF_8 square antiprismatic units. The Pnma phase of TiF_(3), formed using the laser-heated diamond-anvil-cell technique was confirmed via high-pressure x-ray diffraction experiments. Furthermore, the in situ electrical measurements indicate that the newly found Pnma phase has a semiconducting character, which is also consistent with the electronic band structure calculations. Finally, it was shown that this pressure-induced phase transition is a general phenomenon in ScF_(3), VF_(3), CrF_(3), and MnF_(3), offering valuable insights into the high-pressure phases of transition metal trifluorides. 展开更多
关键词 high-pressure structure transition crystal structure prediction high-pressure x-ray diffraction experiments transition metal
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Superior Mechanical Properties of GaAs Driven by Lattice Nanotwinning
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作者 Zhenjiang Han Han Liu +2 位作者 Quan Li Dan Zhou jian lv 《Chinese Physics Letters》 SCIE CAS CSCD 2021年第4期81-86,共6页
Gallium arsenide(GaAs),a typical covalent semiconductor,is widely used in the electronic industry,owing to its superior electron transport properties.However,its brittle nature is a drawback that has so far significan... Gallium arsenide(GaAs),a typical covalent semiconductor,is widely used in the electronic industry,owing to its superior electron transport properties.However,its brittle nature is a drawback that has so far significantly limited its application.An exploration of the structural deformation modes of GaAs under large strain at the atomic level,and the formulation of strategies to enhance its mechanical properties is highly desirable.The stressstrain relations and deformation modes of single-crystal and nanotwinned GaAs under various loading conditions are systematically investigated,using first-principles calculations.Our results show that the ideal strengths of nanotwinned GaAs are 14% and 15% higher than that of single-crystal GaAs under pure and indentation shear strains,respectively,without producing a significantly negative effect in terms of its electronic performance.The enhancement in strength stems from the rearrangement of directional covalent bonds at the twin boundary.Our results offer a fundamental understanding of the mechanical properties of single crystal GaAs,and provide insights into the strengthening mechanism of nanotwinned GaAs,which could prove highly beneficial in terms of developing reliable electronic devices. 展开更多
关键词 LATTICE ELECTRONIC CRYSTAL
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Numerical simulation of plasma response to externally applied resonant magnetic perturbation on the J-TEXT tokamak
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作者 Bicheng LI Zhonghe jianG +3 位作者 jian lv Xiang LI Bo RAO Yonghua DING 《Plasma Science and Technology》 SCIE EI CAS CSCD 2018年第5期23-29,共7页
Nonlinear magnetohydrodynamic(MHD) simulations of an equilibrium on the J-TEXT tokamak with applied resonant magnetic perturbations(RMPs) are performed with NIMROD(non-ideal MHD with rotation,open discussion).Nu... Nonlinear magnetohydrodynamic(MHD) simulations of an equilibrium on the J-TEXT tokamak with applied resonant magnetic perturbations(RMPs) are performed with NIMROD(non-ideal MHD with rotation,open discussion).Numerical simulation of plasma response to RMPs has been developed to investigate magnetic topology,plasma density and rotation profile.The results indicate that the pure applied RMPs can stimulate 2/1 mode as well as 3/1 mode by the toroidal mode coupling,and finally change density profile by particle transport.At the same time,plasma rotation plays an important role during the entire evolution process. 展开更多
关键词 resonant magnetic perturbations tearing mode particle transport
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Synergistic Reinforcement of Phenol-Formaldehyde Resin Composites by Poly(Hexanedithiol)/Graphene Oxide
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作者 Jingliang Wei Chun Wei +2 位作者 Le Su Jun Fu jian lv 《Journal of Materials Science and Chemical Engineering》 2015年第8期56-70,共15页
In this paper, the preparation of graphene oxide was achieved by Hummers method and the surface modification was achieved by poly(hexaneditiol), which was a synthetic thermotropic liquid crystalline polymer. The c-PHD... In this paper, the preparation of graphene oxide was achieved by Hummers method and the surface modification was achieved by poly(hexaneditiol), which was a synthetic thermotropic liquid crystalline polymer. The c-PHDT/GO/PF composites were prepared by blending, rolling and compression molding techniques. Then, the as-prepared samples were characterized by FTIR, Raman, XRD, TGA and POM to obtain information on their structures and properties. After that, the effects of c-PHDT/GO content on the mechanical properties, friction performance and dynamic mechanical performance of c-PHDT/GO/PF composites were studied by Mechanical and Dynamic Mechanical Analysis (DMA) methods. Also, Scanning Electron Microscope (SEM) was used for the characterization of wear and fracture surface morphology. The results revealed that the reinforcing effect of c-PHDT/GO was significant as a considerable enhancement on the mechanical performance of c-PHDT/GO/PF composite as compared to pure phenol-formaldehyde composites was observed: the impact strength, bending modulus and bending strength increased from 1.63 kJ/m2, 8.61 GPa and 41.55 MPa to 2.31 kJ/m2, 10.16 GPa and 54.40 MPa respectively at the c-PHDT/GO content = 0.75%. Moreover, the initial storage modulus increased by 28.4%, while the wear mass loss decreased by 17.8%. More importantly, the reinforcement by c-PHDT/GO was further enhanced as compared to GO/PF and p-PHDT/GO/PF composites, the impact strength of c-PHDT/GO/PF composite increased by 27.6% and 11.1%, the bending strength increased by 11.8% and 7.6%, the initial storage modulus increased by 16.2% and 4.2% and the mass loss due to wear decreased by 12.7% and 8.8%, respectively. Based on these results, we can conclude that the surface modification of GO by poly(hexanedithiol), which includes synergistic effect by c-PHDT and GO, improves the interfacial adhesion between GO and the resin matrix, thus reinforcing the composites. 展开更多
关键词 Poly(Hexanedithiol) Graphene Oxide PHENOL FORMALDEHYDE RESIN Mechanical Properties
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Annulation Cascades of Cyclosulfonium Salts and Alkenes towards Sulfur-Containing N-Heterocycles by Visible Light/Copper Catalysis
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作者 Jie Ma Xufeng Li +4 位作者 Yuqing Chen Yongjia Shi Xiuyan Song jian lv Daoshan Yang 《Chinese Journal of Chemistry》 SCIE CAS CSCD 2024年第14期1637-1643,共7页
Although,great achievements have been made in the synthesis of heterocycles using radical addition/cyclization strategy,developing versatile alkyl radical precursors,especially the non-stabilized long chain alkyl radi... Although,great achievements have been made in the synthesis of heterocycles using radical addition/cyclization strategy,developing versatile alkyl radical precursors,especially the non-stabilized long chain alkyl radicals for this strategy still remains a huge challenge.Herein,we report an efficient annulation cascade reaction between cyclosulfonium salts and alkenes for the synthesis of sulfur-containing N-heterocycles by visible light/copper catalysis under mild conditions.The C—S bond cleavage/radical cascade reaction delivers a variety of corresponding N-heterocycles containing aryl alkyl thioether motifs with good functional group tolerance.Significantly,the current system could be used for the late-stage functionalization of complex bioactive molecules. 展开更多
关键词 Visible light Radical reactions C-C coupling Sulfur heterocycles Photoredox catalysis
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An electron donor-acceptor photoactivation strategy for the synthesis of S-aryl dithiocarbamates using thianthrenium salts under mild aqueous micellar conditions 被引量:2
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作者 Hao Xu Xufeng Li +4 位作者 Jie Ma Junze Zuo Xiuyan Song jian lv Daoshan Yang 《Chinese Chemical Letters》 SCIE CAS CSCD 2023年第11期124-130,共7页
An eco-friendly and convenient method is developed herein for the synthesis of S-aryl dithiocarbamates via visible-light-induced SET process of an EDA complex between thianthrenium salt functionalized arenes and dithi... An eco-friendly and convenient method is developed herein for the synthesis of S-aryl dithiocarbamates via visible-light-induced SET process of an EDA complex between thianthrenium salt functionalized arenes and dithiocarbamate anions under mild aqueous micellar conditions.This strategy indirectly realizes the method for constructing S-aryl dithiocarbamates through site-selective C−H functionalization of arenes.Most importantly,the reaction proceeded smoothly without addition of any photocatalyst,and the by-product thianthrene is recycled in quantity,ultimately minimizing the production of chemical waste.This protocol provides a promising synthesis candidate for the construction of valuable S-aryl dithiocarbamates,which also opens up a new avenue for micellar photocatalysis. 展开更多
关键词 S-Aryl dithiocarbamates Visible-light EDA complex Thianthrenium salts Micellar photocatalysis
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Pipeline versus Tubridge in the treatment of unruptured posterior circulation aneurysms 被引量:1
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作者 Hengwei Jin jian lv +3 位作者 Xiangyu Meng Xinke Liu Hongwei He Youxiang Li 《Chinese Neurosurgical Journal》 CAS CSCD 2023年第4期251-257,共7页
Background To compare the safety and efficacy of pipeline embolization device(PED)and Tubridge flow diverter(TFD)for unruptured posterior circulation aneurysms.Methods Posterior aneurysm patients treated with PED or T... Background To compare the safety and efficacy of pipeline embolization device(PED)and Tubridge flow diverter(TFD)for unruptured posterior circulation aneurysms.Methods Posterior aneurysm patients treated with PED or TFD between January,2019,and December,2021,were retrospectively reviewed.Patients’demographics,aneurysm characteristics,treatment details,complications,and follow-up information were collected.The procedural-related complications and angiographic and clinical outcome were compared.Results A total of 107 patients were involved;PED was applied for 55 patients and TFD for 52 patients.A total of 9(8.4%)procedural-related complications occurred,including 4(7.3%)in PED group and 5(9.6%)in TFD group.During a mean of 10.3-month angiographic follow-up for 81 patients,complete occlusion was achieved in 35(85.4%)patients in PED group and 30(75.0%)in TFD group.The occlusion rate of PED group is slightly higher than that of TFD group.A mean of 25.0-month clinical follow-up for 107 patients showed that favorable clinical outcome was achieved in 53(96.4%)patients in PED group and 50(96.2%)patients in TFD group,respectively.No statistical difference was found in terms of procedural-related complications(p=0.737),occlusion rate(p=0.241),and favorable clinical outcome(0.954)between groups.Conclusions The current study found no difference in complication,occlusion,and clinical outcome between PED and TFD for unruptured PCAs. 展开更多
关键词 Pipeline embolization device Tubridge flow diverter Posterior circulation aneurysm
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Anti-Markovnikov ring-opening of sulfonium salts with alkynes by visible light/copper catalysis
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作者 Xuan Li Min jiang +3 位作者 Junze Zuo Xiuyan Song jian lv Daoshan Yang 《Science China Chemistry》 SCIE EI CAS CSCD 2023年第3期791-798,共8页
Internal alkynes are widespread skeletons in bioactive molecules and materials which are also used as important building blocks in chemical synthesis. Herein, we report a novel and efficient copper-catalyzed Sonogashi... Internal alkynes are widespread skeletons in bioactive molecules and materials which are also used as important building blocks in chemical synthesis. Herein, we report a novel and efficient copper-catalyzed Sonogashira reaction between sulfonium salts and alkynes through an anti-Markovnikov ring-opening pathway promoted by visible light. The coexistence of the nitrogen and phosphorus ligands in the system is the key to the success of this reaction. This radical type ring-opening reaction affords a new strategy for the synthesis of internal alkynes. Furthermore, this study is also an effective complement to the diverse reaction patterns of sulfonium salts. 展开更多
关键词 radical reaction visible-light photocatalysis sulfonium salts copper catalysis ALKYNES
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Rapid formation of Csp^(3)–Csp^(3) bonds through copper-catalyzed decarboxylative Csp^(3)–H functionalization
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作者 Wenwen Cui Yu Li +5 位作者 Xufeng Li Junxin Li Xiuyan Song jian lv Yuan-Ye jiang Daoshan Yang 《Chinese Chemical Letters》 SCIE CAS CSCD 2023年第1期326-332,共7页
Transition-metal-catalyzed decarboxylative and C–H functionalization strategy for the construction of Csp^(2)-Csp^(2),Csp^(2)-Csp,and Csp^(2)-Csp^(3) bonds has been extensively studied.However,research surveys of thi... Transition-metal-catalyzed decarboxylative and C–H functionalization strategy for the construction of Csp^(2)-Csp^(2),Csp^(2)-Csp,and Csp^(2)-Csp^(3) bonds has been extensively studied.However,research surveys of this synthetic strategy for the Csp^(3)-Csp^(3) bond forming reactions are surprisingly scarce.Herein,we present an efficient approach for the rapid formation of Csp^(3)–Csp^(3) bond through copper-catalyzed decarboxylative Csp^(3)–H functionalization.The present method should provide a useful access to C3-substituted indole scaffolds with possible biological activities.Mechanistic experiments and DFT calculations supported a dual-Cu(Ⅱ)-catalytic cycle involving rate-determining decarboxylation in an outer-sphere radical pathway and spin-crossover-promoted C–C bond formation.This strategy offers a promising synthesis method for the construction of Csp^(3)–Csp^(3) bond in the field of synthetic and pharmaceutical chemistry and extends the number of still limited copper-catalyzed decarboxylative Csp^(3)–Csp^(3) bond forming reaction. 展开更多
关键词 Copper CROSS-COUPLING Csp^(3)-H functionaliztion DECARBOXYLATION Csp^(3)–Csp^(3)bond formation
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Interface structure prediction via CALYPSO method 被引量:9
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作者 Bo Gao Pengyue Gao +3 位作者 Shaohua Lu jian lv Yanchao Wang Yanming Ma 《Science Bulletin》 SCIE EI CAS CSCD 2019年第5期301-309,共9页
The atomistic structures of solid–solid interfaces are of fundamental interests for understanding physical properties of interfacial materials. However, determination of interface structures faces a substantial chall... The atomistic structures of solid–solid interfaces are of fundamental interests for understanding physical properties of interfacial materials. However, determination of interface structures faces a substantial challenge, both experimentally and theoretically. Here, we propose an efficient method for predicting interface structures via the generalization of our in-house developed CALYPSO method for structure prediction. We devised a lattice match toolkit that allows us to automatically search for the optimal latticematched superlattice for construction of the interface structures. In addition, bonding constraints(e.g.,constraints on interatomic distances and coordination numbers of atoms) are imposed to generate better starting interface structures by taking advantages of the known bonding environment derived from the stable bulk phases. The interface structures evolve by following interfacially confined swarm intelligence algorithm, which is known to be efficient for exploration of potential energy surface. The method was validated by correctly predicting a number of known interface structures with only given information of two parent solids. The application of the developed method leads to prediction of two unknown grain boundary(GB) structures(r-GB and p-GB) of rutile TiO_2 ∑5(2 1 0) under an O reducing atmosphere that contained Ti^(3+)as the result of O defects. Further calculations revealed that the intrinsic band gap of p-GB is reduced to 0.7 eV owing to substantial broadening of the Ti-3 d interfacial levels from Ti^(3+)centers.Our results demonstrated that introduction of grain boundaries is an effective strategy to engineer the electronic properties and thus enhance the visible-light photoactivity of TiO_2. 展开更多
关键词 Solid-solid interface Structure PREDICTION METHOD LATTICE MISMATCH TiO2 GRAIN boundary
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The direct targets of CBFs:In cold stress response and beyond 被引量:10
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作者 Yue Song Xiaoyan Zhang +7 位作者 Minze Li Hao Yang Diyi Fu jian lv Yanglin Ding Zhizhong Gong Yiting Shi Shuhua Yang 《Journal of Integrative Plant Biology》 SCIE CAS CSCD 2021年第11期1874-1887,共14页
Cold acclimation in Arabidopsis thaliana triggers a significant transcriptional reprogramming altering the expression patterns of thousands of cold-responsive(COR) genes. Essential to this process is the C-repeat bind... Cold acclimation in Arabidopsis thaliana triggers a significant transcriptional reprogramming altering the expression patterns of thousands of cold-responsive(COR) genes. Essential to this process is the C-repeat binding factor(CBF)-dependent pathway, involving the activity of AP2/ERF(APETALA2/ethylene-responsive factor)-type CBF transcription factors required for plant cold acclimation. In this study, we performed chromatin immunoprecipitation assays followed by deep sequencing(ChIP-seq) to determine the genomewide binding sites of the CBF transcription factors. Cold-induced CBF proteins specifically bind to the conserved C-repeat(CRT)/dehydrationresponsive elements(CRT/DRE;G/ACCGAC) of their target genes. A Gene Ontology enrichment analysis showed that 1,012 genes are targeted by all three CBFs. Combined with a transcriptional analysis of the cbf1,2,3 triple mutant, we define 146 CBF regulons as direct CBF targets. In addition, the CBF-target genes are significantly enriched in functions associated with hormone, light,and circadian rhythm signaling, suggesting that the CBFs act as key integrators of endogenous and external environmental cues. Our findings not only define the genome-wide binding patterns of the CBFs during the early cold response, but also provide insights into the role of the CBFs in regulating multiple biological processes of plants. 展开更多
关键词 ARABIDOPSIS CBF target genes CHIP-SEQ cold acclimation
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Fuzzy Self-Adaptation of Mission-Critical Software Under Uncertainty 被引量:7
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作者 Qi-Liang Yang jian lv +3 位作者 Xian-Ping Tao Xiao-Xing Ma jian-Chun Xing Wei Song 《Journal of Computer Science & Technology》 SCIE EI CSCD 2013年第1期165-187,共23页
Mission-critical software (MCS) must provide continuous, online services to ensure the successful accomplish- ment of critical missions. Self-adaptation is particularly desirable for assuring the quality of service ... Mission-critical software (MCS) must provide continuous, online services to ensure the successful accomplish- ment of critical missions. Self-adaptation is particularly desirable for assuring the quality of service (QoS) and availability of MCS under uncertainty. Few techniques have insofar addressed the issue of MCS self-adaptation, and most existing approaches to software self-adaptation fail to take into account uncertainty in the self-adaptation loop. To tackle this problem, we propose a fuzzy control based approach, i.e., Software Fuzzy Self-Adaptation (SFSA), with a view to deal with the challenge of MCS self-adaptation under uncertainty. First, we present the SFSA conceptual framework, consisting of sensing, deciding and acting stages, and establish the formal model of SFSA to lay a rigorous and mathematical foundation of our approach. Second, we develop a novel SFSA implementation technology as well as its supporting tool, i.e., the SFSA toolkit, to automate the realization process of SFSA. Finally, we demonstrate the effectiveness of our approach through the development of an adaptive MCS application in process control systems. Validation experiments show that the fuzzy control based approach proposed in this work is effective and with low overheads. 展开更多
关键词 mission-critical software software self-adaptation fuzzy self-adaptation fuzzy control self-adaptation logic weaving
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JAMIP:an artificial-intelligence aided data-driven infrastructure for computational materials informatics 被引量:6
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作者 Xin-Gang Zhao Kun Zhou +13 位作者 Bangyu Xing Ruoting Zhao Shulin Luo Tianshu Li Yuanhui Sun Guangren Na Jiahao Xie Xiaoyu Yang Xinjiang Wang Xiaoyu Wang Xin He jian lv Yuhao Fu Lijun Zhang 《Science Bulletin》 SCIE EI CSCD 2021年第19期1973-1985,M0003,共14页
Materials informatics has emerged as a promisingly new paradigm for accelerating materials discovery and design.It exploits the intelligent power of machine learning methods in massive materials data from experiments ... Materials informatics has emerged as a promisingly new paradigm for accelerating materials discovery and design.It exploits the intelligent power of machine learning methods in massive materials data from experiments or simulations to seek new materials,functionality,and principles,etc.Developing specialized facilities to generate,collect,manage,learn,and mine large-scale materials data is crucial to materials informatics.We herein developed an artificial-intelligence-aided data-driven infrastructure named Jilin Artificial-intelligence aided Materials-design Integrated Package(JAMIP),which is an open-source Python framework to meet the research requirements of computational materials informatics.It is integrated by materials production factory,high-throughput first-principles calculations engine,automatic tasks submission and monitoring progress,data extraction,management and storage system,and artificial intelligence machine learning based data mining functions.We have integrated specific features such as an inorganic crystal structure prototype database to facilitate high-throughput calculations and essential modules associated with machine learning studies of functional materials.We demonstrated how our developed code is useful in exploring materials informatics of optoelectronic semiconductors by taking halide perovskites as typical case.By obeying the principles of automation,extensibility,reliability,and intelligence,the JAMIP code is a promisingly powerful tool contributing to the fast-growing field of computational materials informatics. 展开更多
关键词 DATA-DRIVEN Materials informatics Computational material First-principles calculation High-throughput calculation
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Reciprocal regulation between the negative regulator PP2CG1 phosphatase and the positive regulator OST1 kinase confers cold response in Arabidopsis 被引量:4
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作者 jian lv Jingyan Liu +5 位作者 Yuhang Ming Yiting Shi Chunpeng Song Zhizhong Gong Shuhua Yang Yanglin Ding 《Journal of Integrative Plant Biology》 SCIE CAS CSCD 2021年第8期1568-1587,共20页
Protein phosphorylation and dephosphorylation have been reported to play important roles in plant cold responses.In addition,phospho-regulatory feedback is a conserved mechanism for biological processes and stress res... Protein phosphorylation and dephosphorylation have been reported to play important roles in plant cold responses.In addition,phospho-regulatory feedback is a conserved mechanism for biological processes and stress responses in animals and plants.However,it is less well known that a regulatory feedback loop is formed by the protein kinase and the protein phosphatase in plant responses to cold stress.Here,we report that OPEN STOMATA 1(OST1)and PROTEIN PHOSPHATASE 2C G GROUP 1(PP2CG1)reciprocally regulate the activity during the cold stress response.The interaction of PP2CG1 and OST1 is inhibited by cold stress,which results in the release of OST1 at the cytoplasm and nucleus from suppression by PP2CG1.Interestingly,cold-activated OST1 phosphorylates PP2CG1 to suppress its phosphatase activity,thereby amplifying cold signaling in plants.Mutations of PP2CG1 and its homolog PP2CG2 enhance freezing tolerance,whereas overexpression of PP2CG1 decreases freezing tolerance.Moreover,PP2CG1 negatively regulates protein levels of C-REPEAT BINDING FACTORs(CBFs)under cold stress.Our results uncover a phosphor/dephosphor-regulatory feedback loop mediated by PP2CG1 phosphatase and OST1 protein kinase in plant cold responses. 展开更多
关键词 ARABIDOPSIS feedback loop freezing stress protein kinase OST1 protein phosphatases PP2CG1/2
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