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Big Data Application Simulation Platform Design for Onboard Distributed Processing of LEO Mega-Constellation Networks
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作者 Zhang Zhikai Gu Shushi +1 位作者 Zhang Qinyu Xue Jiayin 《China Communications》 SCIE CSCD 2024年第7期334-345,共12页
Due to the restricted satellite payloads in LEO mega-constellation networks(LMCNs),remote sensing image analysis,online learning and other big data services desirably need onboard distributed processing(OBDP).In exist... Due to the restricted satellite payloads in LEO mega-constellation networks(LMCNs),remote sensing image analysis,online learning and other big data services desirably need onboard distributed processing(OBDP).In existing technologies,the efficiency of big data applications(BDAs)in distributed systems hinges on the stable-state and low-latency links between worker nodes.However,LMCNs with high-dynamic nodes and long-distance links can not provide the above conditions,which makes the performance of OBDP hard to be intuitively measured.To bridge this gap,a multidimensional simulation platform is indispensable that can simulate the network environment of LMCNs and put BDAs in it for performance testing.Using STK's APIs and parallel computing framework,we achieve real-time simulation for thousands of satellite nodes,which are mapped as application nodes through software defined network(SDN)and container technologies.We elaborate the architecture and mechanism of the simulation platform,and take the Starlink and Hadoop as realistic examples for simulations.The results indicate that LMCNs have dynamic end-to-end latency which fluctuates periodically with the constellation movement.Compared to ground data center networks(GDCNs),LMCNs deteriorate the computing and storage job throughput,which can be alleviated by the utilization of erasure codes and data flow scheduling of worker nodes. 展开更多
关键词 big data application Hadoop LEO mega-constellation multidimensional simulation onboard distributed processing
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Research on the Application of Virtual Simulation Technology in the Safety Management of Coal Mining
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作者 Siqi Cheng Tianyi Jia +1 位作者 Nana Deng Xiaowen Ma 《Journal of Electronic Research and Application》 2024年第3期249-254,共6页
Safety is paramount in coal mining as it affects efficiency.Thus,it is essential to enhance the management of coal mine safety.With the ongoing advancement of modern technologies,more innovative solutions are being in... Safety is paramount in coal mining as it affects efficiency.Thus,it is essential to enhance the management of coal mine safety.With the ongoing advancement of modern technologies,more innovative solutions are being integrated into the safety management of coal mining,including virtual simulation technology.This paper focuses on analyzing and researching the application of virtual simulation technology in the safety management of coal mining,providing insights for reference. 展开更多
关键词 Virtual simulation technology Coal mine safety management application
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Current Status of Clinical Application and Basic Research on Draba nemerosa Hebecarpa Jujube Lung-Diarrhoea Soup
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作者 Yong Fan 《Journal of Biosciences and Medicines》 2024年第5期144-153,共10页
The clinical application and basic research of Draba nemerosa Hebecarpa jujube diarrhoea lung soup focus on respiratory diseases and circulatory diseases, and its clinical application is more compared with the basic r... The clinical application and basic research of Draba nemerosa Hebecarpa jujube diarrhoea lung soup focus on respiratory diseases and circulatory diseases, and its clinical application is more compared with the basic research, and Draba nemerosa Hebecarpa jujube diarrhoea lung soup is mostly used in the form of “Draba nemerosa Hebecarpa Hebecarpa jujube diarrhoea lung soup with additional subtractions or other formulas combining Draba nemerosa Hebecarpa Hebecarpa Hebecarpa jujube diarrhoea lung soup” in the clinical application. This article will focus on the main mechanisms of Draba nemerosa Hebecarpa jujube diarrhoea lung soup and its main components in the treatment of respiratory and circulatory diseases, and will give a review of the basic research on Draba nemerosa Hebecarpa Hebecarpa jujube diarrhoea lung soup as follows. 展开更多
关键词 Draba nemerosa Hebecarpa Jujube Laxative Lung Soup Clinical application basic Research
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Sheet Metal Forming Simulation and Its Application in Stamping Process of Automobile Panels 被引量:4
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作者 张扬 张连洪 +1 位作者 李双义 王洪志 《Transactions of Tianjin University》 EI CAS 2002年第4期269-272,共4页
The paper starts with a brief overview to the necessity of sheet metal forming simulation and the complexity of automobile panel forming, then leads to finite element analysis (FEA) which is a powerful simulation too... The paper starts with a brief overview to the necessity of sheet metal forming simulation and the complexity of automobile panel forming, then leads to finite element analysis (FEA) which is a powerful simulation tool for analyzing complex three-dimensional sheet metal forming problems. The theory and features of the dynamic explicit finite element methods are introduced and the available various commercial finite element method codes used for sheet metal forming simulation in the world are discussed,and the civil and international status quo of automobile panel simulation as well. The front door outer panel of one certain new automobile is regarded as one example that the dynamic explicit FEM code Dynaform is used for the simulation of the front door outer panel forming process. Process defects such as ruptures are predicted. The improving methods can be given according to the simulation results. Foreground of sheet metal forming simulation is outlined. 展开更多
关键词 finite element analysis dynamic explicit methods sheet metal forming finite element method codes automobile panel computer simulation application
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Discussion on the application prospect of the transient electromagnetic method based on the dual launcher and mine advanced detection
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作者 Zhen Yang Huizhou Liu +5 位作者 Shengqing Wang Yu Cao Ya Dong Chenghu Niu Weiwen Song Guoxin Xie 《World Journal of Condensed Matter Physics》 CAS 2024年第1期21-33,共13页
The dual transmitter implements the equivalent anti-magnetic flux transient electromagnetic method, which can effectively reduce the scope of the transient electromagnetic detection blind area. However, this method is... The dual transmitter implements the equivalent anti-magnetic flux transient electromagnetic method, which can effectively reduce the scope of the transient electromagnetic detection blind area. However, this method is rarely reported in the detection of pipelines in urban geophysical exploration and the application of coal mines. Based on this, this paper realizes the equivalent anti-magnetic flux transient electromagnetic method based on the dual launcher. The suppression effect of this method on the blind area is analyzed by physical simulation. And the detection experiment of underground pipelines is carried out outdoors. The results show that the dual launcher can significantly reduce the turn-off time, thereby effectively reducing the impact of the blind area on the detection results, and the pipeline detection results verify the device’s effectiveness. Finally, based on the ground experimental results, the application prospect of mine advanced detection is discussed. Compared with other detection fields, the formation of blind areas is mainly caused by the equipment. If the dual launcher can be used to reduce the blind area, the accuracy of advanced detection can be improved more effectively. The above research results are of great significance for improving the detection accuracy of the underground transient electromagnetic method. 展开更多
关键词 A Dual Launcher Physical simulation Transient Electromagnetic Method Mine Geophysical Prospecting Detection Blind Area application Prospect
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Research and Application Prospect of Computer Simulation on Heat Treatment Process 被引量:19
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作者 Pan Jiansheng, Li Yongjun, Cu Jianfeng, Hu Mingjuan Open Research Lab for High Temperature Materials & Testing, SJTU, Shanghai, 200030 《Journal of Shanghai Jiaotong university(Science)》 EI 2000年第1期1-13,共13页
In this paper, a modified temperature-phase transformation-stress/strain field coupled 3D non-linear mathematical model was used in the computer simulation on heat treatment processes of workpieces including catch jaw... In this paper, a modified temperature-phase transformation-stress/strain field coupled 3D non-linear mathematical model was used in the computer simulation on heat treatment processes of workpieces including catch jaw, anchor ring, cold roller, large-scale bearing roller, nitriding crank shaft, etc. The simulation on complicated technologies such as pre-cooled quenching, double media quenching, self-tempering, difference temperature heating, nitriding distortion was carried out. The optimum design of heat treatment technology has been realized. The successful application of computer simulation on heat treatment have also been demonstrated. 展开更多
关键词 HEAT TREATMENT MATHEMATICAL Model COMPUTER simulation MANUFACTURE application
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Study and Application of Mold Filling Simulation of Shaped Castings 被引量:5
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作者 Baicheng LIU Wei QIU +1 位作者 Houfa SHEN Zhiqiang GAO (Dept. of Mechanical Engineering, Tsinghua University Beijing 100084, China) 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 1997年第2期107-112,共6页
In this paper, an algorithm for simulating fluid flow and heat transfer for mold filling of shaped castings is presented. The main features of the algorithm include: 1) a simple but practical technique based on VOF me... In this paper, an algorithm for simulating fluid flow and heat transfer for mold filling of shaped castings is presented. The main features of the algorithm include: 1) a simple but practical technique based on VOF method to determine free surface, 2) an explicit scheme of enthalpy to solve the energy equation more efficiently, and 3) an effective treatment to modify the flux deviation due to pressure iteration. In order to verify these methods, well controlled experiments have been repeatedly done with both water analog and gray iron pouring experiments to record the flow patterns and temperature variations. The calculated results are in accordance with the experimental ones. For the applications, the simulated initial temperature distribution right after mold filling was used to analyse subsequent solidification and to predict shrinkage defects. Actual castings were poured and tested in a foundry plant. The reuslts show that the defects predication with considering fluid flow effects is more precise than that without considering the effects. 展开更多
关键词 simulation Study and application of Mold Filling simulation of Shaped Castings MOLD
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POWER FLOW ANALYSIS AND APPLICATION SIMULATION OF ELECTROMAGNETIC CONTINUOUSLY VARIABLE TRANSMISSION 被引量:3
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作者 LUO Yutao TAN Di MENG Fanzhen 《Chinese Journal of Mechanical Engineering》 SCIE EI CAS CSCD 2008年第6期48-56,共9页
With the structure of two air gaps and two rotors, the electromagnetic continuously variable transmission(EMCVT) is a novel power-split continuously variable transmission(CVT). There are two kinds of power flowing... With the structure of two air gaps and two rotors, the electromagnetic continuously variable transmission(EMCVT) is a novel power-split continuously variable transmission(CVT). There are two kinds of power flowing through the EMCVT, one is mechanical power and the other is electric power. In the mean time, there are three power ports in the EMCVT, one is the outer rotor named mechanical power port and the other two are the inner rotor and the stator named electric power ports. The mechanical power port is connected to the driving wheels through the final gear and the electric ports are connected to the batteries through the transducers. The two kinds of power are coupled on the outer rotor of the EMCVT. The EMCVT can be equipped on the conventional vehicle being regarded as the CVT and it also can be equipped on the hybrid electric vehicle(HEV) as the multi-energy sources assembly. The power flows of these two kinds of applications are analysed. The back electromotive force(EMF) equations are illatively studied and so the dynamic mathematic model is theorized. In order to certify the feasibility of the above theories, three simulations are carried out in allusion to the above two kinds of mentioned applications of the EMCVT and a five speed automatic transmission(AT) vehicle. The simulation results illustrate that the efficiency of the EMCVT vehicles is higher than that of the AT vehicle owed to the optimized operation area of the engine. Hence the fuel consumption of the EMCVT vehicles is knock-down. 展开更多
关键词 Electromagnetic continuously variable transmission Power flow analysis back electromotive force application simulation
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Database application platform for earthquake numerical simulation
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作者 罗艳 郑月军 +2 位作者 陈连旺 陆远忠 黄忠贤 《Acta Seismologica Sinica(English Edition)》 CSCD 2006年第6期720-723,共4页
Introduction In recent years, all kinds of observation networks of seismology have been established, which have been continuously producing numerous digital information. In addition, there are many study results about... Introduction In recent years, all kinds of observation networks of seismology have been established, which have been continuously producing numerous digital information. In addition, there are many study results about 3D velocity structure model and tectonic model of crust (Huang and Zhao, 2006; Huang et al, 2003; Li and Mooney, 1998), which are valuable for studying the inner structure of the earth and earthquake preparation process. It is badly needed to combine the observed data, experimental study and theoretical analyses results by the way of numerical simulation and develop a database and a corresponding application platform to be used by numerical simulation, and is also a significant way to promote earthquake prediction. 展开更多
关键词 earthquake numerical simulation DATABASE application platform development
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Setup and application of a structural seismic hybrid simulation system on local area network
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作者 王大鹏 《Journal of Chongqing University》 CAS 2012年第3期103-111,共9页
To implement structural hybrid simulation independent of the control system of any testing equipment in civil engineering, an external command control approach is put forward. Several setup technologies and the corres... To implement structural hybrid simulation independent of the control system of any testing equipment in civil engineering, an external command control approach is put forward. Several setup technologies and the corresponding API approaches are investigated to simultaneously combine numerical simulation with physical testing. Hybrid program technology is put forward and described in detail, using Visual C++ program to effectively and accurately control testing equipment and MATLAB program to implement numerical simulation with easy extension. The control program of testing equipment and numerical simulation program are integrated by calling MATLAB engine in Visual C++. A hybrid simulation about a full-scale six-story masonry structure is carried out. The testing results manifest that the external command control approach has the versatility because of simple hardware connection and control program independent on control software of testing equipment; powerful program function of Visual C++ and flexible program of MATLAB are integrated by hybrid program technology; hybrid simulation system provides a realistic and cost-effective testing platform that enables earthquake engineer researchers to accurately and efficiently capture the seismic performance of large or complex structures without having to carry out physical testing of the entire structure. 展开更多
关键词 hybrid simulation external command control application program interface hybrid program control structural seismic testing
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Application and Analysis of Computer Virtual Simulation Technology in Three-dimensional Animation Production
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作者 Le Qiu 《管理科学与研究(中英文版)》 2019年第1期19-21,共3页
With the continuous promotion of computer technology, the application system of virtual simulation technology has been further optimized and improved, and has been widely used in various fields of social development, ... With the continuous promotion of computer technology, the application system of virtual simulation technology has been further optimized and improved, and has been widely used in various fields of social development, such as urban construction, interior design, industrial simulation and tourism teaching. China's three-dimensional animation production started relatively late, but has achieved good results with the support of related advanced technology in the process of development. Computer virtual simulation technology is an important technical support in the production of three-dimensional animation. In this paper, firstly, the related content of computer virtual simulation technology was introduced. Then, the specific application of this technology in the production of three-dimensional animation was further elaborated, so as to provide some reference for the improvement of the production effect of three-dimensional animation in the future. 展开更多
关键词 COMPUTER VIRTUAL simulation Technology THREE-DIMENSIONAL ANIMATION PRODUCTION application
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Increasing the Safety of People Activity in Aggressive Potential Locations, Analyzed through the Probability Theory, Modeling/Simulation and Application in Underground Coal Mining
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作者 Emil Pop Gabriel-Ioan Ilcea +1 位作者 Ionut-Alin Popa Lorand Bogdanffy 《Engineering(科研)》 2019年第2期93-106,共14页
This paper deals with the increasing safety of working in aggressive potential locations, having SCADA system and WSN sensors, using a “probabilistic strategy” in comparison with a “deterministic” one, modeling/si... This paper deals with the increasing safety of working in aggressive potential locations, having SCADA system and WSN sensors, using a “probabilistic strategy” in comparison with a “deterministic” one, modeling/simulation and application in underground coal mining. In general, three conditions can be considered: 1) an unfriendly environment that facilitates the risk of accidents, 2) aggressive equipments that can compete to cause accidents and 3) the work security breaches that can cause accidents. These conditions define the triangle of accidents and are customized for an underground coal mining where the methane gas is released with the exploitation of the massive coal. In this case, the first two conditions create an explosive potential atmosphere. To allow people to work in a safe location it needs: first, a continuing monitoring through SCADA system of the explosive potential atmosphere and second, the use of antiexplosive equipment. This method, named “deterministic strategy”, increases the safety of working, but the explosions have not been completely eliminated. In order to increase the safety of working, the paper continues with the presentation of a new method based on hazard laws, named “probabilistic strategy”. This strategy was validated through modeling/simulation using CupCarbon software platform, and application of WSN networks implemented on Arduino equipments. At the end of the paper the interesting conclusions are emphases which are applicable to both strategies. 展开更多
关键词 Accident Potentially SAFETY Zone TRIANGLE of Accidents Hazard LAWS Deterministic STRATEGY Probabilistic STRATEGY CupCarbon Modeling and simulation WSN applications Arduino Implementation Example
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Application of Project-Based Teaching in Practical Teaching of Manual Accounting Simulation
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作者 Jie Li 《Journal of Educational Theory and Management》 2017年第1期52-55,共4页
In this paper, the author explained characteristics of project-based teaching in practical training of manual accounting simulation, and clarified significance of project-based teaching in accounting simulation teachi... In this paper, the author explained characteristics of project-based teaching in practical training of manual accounting simulation, and clarified significance of project-based teaching in accounting simulation teaching and relevant application researches based on analysis on comprehensive manual accounting simulation. Also, to improve effects of project-based teaching in manual accounting simulation courses, teachers need to pay attention to multiple questions during the application. 展开更多
关键词 PROJECT-BASED teaching PRACTICAL training of MANUAL ACCOUNTING simulation application
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Application of computer aided 3D simulation technique for complicated foot and ankle fractures
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作者 章莹 《外科研究与新技术》 2011年第2期109-110,共2页
Objective To investigate the effect of computer aided 3D simulation technique for treating complicated foot and ankle fractures precisely.Methods From November 2007 to August 2009,255 patients with complicated foot an... Objective To investigate the effect of computer aided 3D simulation technique for treating complicated foot and ankle fractures precisely.Methods From November 2007 to August 2009,255 patients with complicated foot and ankle fractures 展开更多
关键词 application of computer aided 3D simulation technique for complicated foot and ankle fractures
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Ferroelectricity of hafnium oxide-based materials:Current status and future prospects from physical mechanisms to device applications
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作者 Wanwang Yang Chenxi Yu +9 位作者 Haolin Li Mengqi Fan Xujin Song Haili Ma Zheng Zhou Pengying Chang Peng Huang Fei Liu Xiaoyan Liu Jinfeng Kang 《Journal of Semiconductors》 EI CAS CSCD 2023年第5期78-121,共44页
The finding of the robust ferroelectricity in HfO_(2)-based thin films is fantastic from the view point of both the fundamentals and the applications.In this review article,the current research status of the future pr... The finding of the robust ferroelectricity in HfO_(2)-based thin films is fantastic from the view point of both the fundamentals and the applications.In this review article,the current research status of the future prospects for the ferroelectric HfO_(2)-based thin films and devices are presented from fundamentals to applications.The related issues are discussed,which include:1)The ferroelectric characteristics observed in HfO_(2)-based films and devices associated with the factors of dopant,strain,interface,thickness,defect,fabrication condition,and more;2)physical understanding on the observed ferroelectric behaviors by the density functional theory(DFT)-based theory calculations;3)the characterizations of microscopic and macroscopic features by transmission electron microscopes-based and electrical properties-based techniques;4)modeling and simulations,5)the performance optimizations,and 6)the applications of some ferroelectric-based devices such as ferroelectric random access memory,ferroelectric-based field effect transistors,and the ferroelectric tunnel junction for the novel information processing systems. 展开更多
关键词 FERROELECTRICITY HfO_(2)-based thin films physical mechanism characterization modeling and simulation applications
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Numerical Simulation of Decarburization in a Top-Blown Basic Oxygen Furnace 被引量:1
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作者 Miguel A. Barron Dulce Y. Medina Isaias Hilerio 《Modeling and Numerical Simulation of Material Science》 2014年第3期94-103,共10页
An improved mathematical model to describe the decarburization process in basic oxygen furnaces for steelmaking is presented in this work. This model takes into account those factors or parameters that determine the b... An improved mathematical model to describe the decarburization process in basic oxygen furnaces for steelmaking is presented in this work. This model takes into account those factors or parameters that determine the bath-oxygen impact area, such as the cavity depth, the lance height, the number of nozzles and the nozzles diameter. In the thermal issue, the model includes the targeted carbon content and temperature. The model is numerically solved, and is validated using reported data plant. The oxygen flow rate and the lance height are varied in the numerical simulations to study their effect on the carbon content and decarburization rate. 展开更多
关键词 basic OXYGEN FURNACE Carbon Content DECARBURIZATION LANCE HEIGHT Numerical simulation OXYGEN Flow Rate OXYGEN STEELMAKING
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Providing insight into exchange coupling within nanomagnetism:mechanism,micromagnetic simulation,synthesis and biomedical application
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作者 Yuting Tang Feng Feng +4 位作者 Guanhua Xu Shijie Qin Xiaoping Ouyang Li Yao Xiuyu Wang 《Science China Materials》 SCIE EI CAS CSCD 2024年第10期3049-3082,共34页
Exchange coupling within nanomagnetism is a rapidly evolving field with significant implications for that plays a crucial role in the development of magnetic nanomaterials.Manipulating exchange coupling interaction en... Exchange coupling within nanomagnetism is a rapidly evolving field with significant implications for that plays a crucial role in the development of magnetic nanomaterials.Manipulating exchange coupling interaction enables the magnetic systems to overcome limitations associated with size-dependent magnetic behavior within nano scale,thereby improving their magnetic properties and providing for superior performance in biomedical applications compared with single-phase magnetic materials.Understanding the underlying mechanism of exchange coupling and its impact on macroscopic magnetic properties is crucial for the design and application of such magnetic materials.This review provides an overview of recent advances in interfacial exchange coupling among different magnetic modalities-ferromagnetism,ferrimagnetism,and antiferromagnetism-based on core-shell magnetic nanoparticles(MNPs).Additionally,this review discusses micromagnetic simulations to gain insights into the relationship between the microscopic magnetic structure(size,shape,composition,and exchange coupling)and the resulting macroscopic properties.The controlled synthesis of MNPs is summarized,including one-step method and two-step method.The precise manipulation of interfacial characteristics is of great importance,albeit challenging,as it allows for the finetuning of magnetic properties tailored for specific applications.The review also explores potential applications of coreshell MNPs in magnetic resonance imaging,hyperthermia therapy,targeted drug delivery,and advanced neuromodulation. 展开更多
关键词 nano magnetism heterogeneous interfaces exchange coupling micromagnetic simulation biomedical application
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Development of Management and Application System of Basic Meteorological Data
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作者 Hou Yiguang Zhao Jin +1 位作者 Li Bingfeng Wang Xiao 《Meteorological and Environmental Research》 CAS 2015年第7期17-22,共6页
Based on convenience and safety of historical data application, B/S mode is used instead of database management structure of C/S mode, and it can not only combine database and network, but also realize the safe use of... Based on convenience and safety of historical data application, B/S mode is used instead of database management structure of C/S mode, and it can not only combine database and network, but also realize the safe use of historical data online. High-level programming language is used to develop a online management and application system of historical meteorological data based on B/S mode. System data import function can import ground report file sequence of Xuzhou ( including five county-level stations) into the database, construct Oracle database of Xuzhou and the five stations since 1953, and establish data tables of time, day, ten-day, monthly, quarterly and annual historical data, weather information and so forth. Management software of database server is established to realize instruction-level management and scheduling of database and a balanced distribution of resources among users. At the same time, a Web-based management application interface is set up to meet users' needs to retrieve a variety of repositories, and it provides statistical query of time, day, ten-day, monthly, quarterly and annual historical data and climate data for each meteorological element, thereby meeting the needs of meteorological research and all sectors of society for statistical query of meteorological data. 展开更多
关键词 basic meteorological data Management and application systems Web application China
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APPLICATION OF MONTE-CARLO SIMULATED ANNEALING ON CONFORMATIONAL ANALYSIS
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作者 Qiao Lin DENG Yu Zhen HAN Lu Hua LAI Xiao Jie XU You Qi TANG Institute of Physical Chemistry, Peking University, Beijing 100871 Ming Hong Hao Institute of Molecular Science, Shanxi University, Taiyuan 《Chinese Chemical Letters》 SCIE CAS CSCD 1991年第10期809-812,共4页
Monte-Carlo simulated annealing method (SA) was applied to the conformational analysis of flexible molecules such as peptides. The programs SAMM and SAPEP have been developed, using MM2 force field for organic molecul... Monte-Carlo simulated annealing method (SA) was applied to the conformational analysis of flexible molecules such as peptides. The programs SAMM and SAPEP have been developed, using MM2 force field for organic molecules and ECEPP/2 force field for peptides respectively. 展开更多
关键词 TH application OF MONTE-CARLO simulATED ANNEALING ON CONFORMATIONAL ANALYSIS DE FLEXIBLE
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Molecular Simulation Studies on Basicity of Nitrogen-containing Compounds
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作者 Wang Lixin Zhou Han +1 位作者 Dai Zhenyu Shen Xizhou 《China Petroleum Processing & Petrochemical Technology》 SCIE CAS 2009年第3期62-67,共6页
The DFT-based (density fimctional theory) ab initio quantum mechanical methods have been applied to study the basicity of the nitrogen-containing compounds in petroleum. The results have indicated that there is a di... The DFT-based (density fimctional theory) ab initio quantum mechanical methods have been applied to study the basicity of the nitrogen-containing compounds in petroleum. The results have indicated that there is a distinct relationship between the protonation energy of nitrogen-containing compounds and their basicity. The more negative the protonation energy, the stronger the basicity is. It has been also found that aliphatic amines are more basic than pyridines or aromatic amines, and all these compounds are more basic than pyrroles. The addition of the aromatic rings can influence the basicity of anilines, while the 5- and 6-membered heterocyclic compounds function differently. The solvent properties may affect the basicity of these nitrogen-containing compounds. 展开更多
关键词 nitrogen-containing compounds basicITY quantum mechanics molecular simulation solvent effect
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