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Research on the Upper Limit of Accuracy for Predicting Theoretical Tandem Mass Spectrometry

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Journal of Computer and Communications 2024年第3期12卷 184-195页

作者： Changjiu He Xiaoyu Wang mingming lyu Xinye Bian School of Computer Science and Technology Shandong University of Technology Zibo China

In recent years, numerous theoretical tandem mass spectrometry prediction methods have been proposed, yet a systematic study and evaluation of their theoretical accuracy limits have not been conducted. If the accuracy of current methods approaches this limit, further exploration of new prediction techniques may become redundant. Conversely, a need for more precise prediction methods or models may be indicated. In this study, we have experimentally analyzed the limits of accuracy at different numbers of ions and parameters using repeated spectral pairs and integrating various similarity metrics. Results show significant achievements in accuracy for backbone ion methods with room for improvement. In contrast, full-spectrum prediction methods exhibit greater potential relative to the theoretical accuracy limit. Additionally, findings highlight the significant impact of normalized collision energy and instrument type on prediction accuracy, underscoring the importance of considering these factors in future theoretical tandem mass spectrometry predictions.

关键词： Tandem Mass Spectrometry Spectral Prediction Theoretical Limit

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基于θ算子的多粒度直觉模糊粗糙集模型

计算机科学 2024年第8期51卷 83-96页

作者：郑宇薛占熬吕明明徐久成河南师范大学计算机与信息工程学院河南新乡453000 智慧商务与物联网技术河南省工程实验室河南新乡453000

针对在多属性决策中决策者难以在多个属性相互冲突时做出准确判断的问题,文中在直觉模糊近似空间中,首先利用直觉模糊集的隶属度、非隶属度与模糊蕴含算子,提出了基于θ算子和θ*算子的直觉模糊集及其隶属度和非隶属度的概念,并证明了... 详细信息

针对在多属性决策中决策者难以在多个属性相互冲突时做出准确判断的问题,文中在直觉模糊近似空间中,首先利用直觉模糊集的隶属度、非隶属度与模糊蕴含算子,提出了基于θ算子和θ*算子的直觉模糊集及其隶属度和非隶属度的概念,并证明了它们的一系列性质。然后,在直觉模糊集与多粒度粗糙集上,定义基于θ算子的多粒度直觉模糊粗糙集的悲观、乐观模型,讨论两种模型的相关性质。最后,给出了基于θ算子的多粒度直觉模糊粗糙集模型的多属性决策算法,将高校引进的人才评价和企业绿色经济供应链的商家评价作为实例进行了分析,同时还与已有方法进行了分析对比,用乐观、悲观模型与已有方法的决策结果的对比证明了所提方法的正确性,并验证了该模型算法的有效性。

关键词：粗糙集直觉模糊集蕴含算子多粒度多属性决策

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基于直觉模糊相似关系的三支决策模型

数据采集与处理 2024年第3期39卷 617-633页

作者：吕明明薛占熬杨梦丽辛现伟孙林河南师范大学计算机与信息工程学院新乡453000 智慧商务与物联网技术河南省工程实验室新乡453000

针对一些直觉模糊相似关系使直觉模糊集中对象间的相似度过于集中或者相异度过高,导致不合理的分类结果的问题,以及在构造直觉模糊相似关系时,对象间的相似度和相异度容易受到不重要属性条件信息影响的问题,本文在直觉模糊集和可能性理... 详细信息

针对一些直觉模糊相似关系使直觉模糊集中对象间的相似度过于集中或者相异度过高,导致不合理的分类结果的问题,以及在构造直觉模糊相似关系时,对象间的相似度和相异度容易受到不重要属性条件信息影响的问题,本文在直觉模糊集和可能性理论基础上,提出一种基于直觉模糊相似关系的三支决策模型。首先,给出可能性测度和必要性测度的定义,结合Hausdorff度量,构造一种距离公式,并证明其性质,定义了直觉模糊集中对象间的相似度和相异度,构造了新的直觉模糊相似关系;然后定义了直觉模糊相似关系下的(λ_(1),λ_(2))-截集及其直觉模糊(λ_(1),λ_(2))-截集下的相似类,并进一步求出目标集的正域、负域和边界域;最后通过UCI数据集和实例验证了该模型的合理性和有效性。

关键词：直觉模糊相似关系可能性理论三支决策截集相似度相异度

Smoothed-Particle Hydrodynamics Simulation of Ship Motion and Tank Sloshing under the Effect of Regular Waves

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Fluid Dynamics & Materials Processing 2024年第5期20卷 1045-1061页

作者： mingming Zhao Jialong Jiao School of Civil Engineering and Transportation South China University of TechnologyGuangzhou510641China

Predicting the response of liquefied natural gas(LNG)contained in vessels subjected to external waves is extremely important to ensure the safety of the transportation *** this study,the coupled behavior due to ship motion and liquid tank sloshing has been simulated by the Smoothed-Particle Hydrodynamics(SPH)***,the sloshing flow in a rectangular tank was simulated and the related loads were analyzed to verify and validate the accuracy of the present SPH ***,a three-dimensional simplified LNG carrier model,including two prismatic liquid tanks and a wave tank,was *** conditions were examined corresponding to different wave lengths,wave heights,wave heading angles,and tank loading ***,the effects of liquid tank loading rate on LNG ship motions and sloshing loading were analyzed,thereby showing that the SPH method can effectively provide useful indications for the design of liquid cargo ships.

关键词： LNG carrier tank sloshing seakeeping inner and external fluid coupling Smoothed Particle Hydrodynamics(SPH)

Cr-containing wastewater treatment based on Cr self-catalysis: a critical review

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Frontiers of Environmental Science & Engineering 2024年第1期18卷 1-22页

作者： Manshu Zhao Xinhua Wang Shuguang Wang mingming Gao School of Environmental Science and Engineering Shandong UniversityQingdao 266237China Shandong Key Laboratory of Environmental Processes and Health Shandong UniversityQingdao 266237China Shandong Key Laboratory of Water Pollution Control and Resource Reuse Shandong UniversityQingdao 266237China Weihai Research Institute of Industrial Technology of Shandong University Weihai 264209China

Chromium (Cr), as a transition metal material with multiple redox states, has exhibited the catalysis toward Fenton-like reactions over a wide pH range. Although it is not sensible to add Cr reagents as catalysts due to its toxicity, it is highly promising to remediate Cr-containing wastewater through Cr-initiated advanced oxidation processes (Cr-initiated AOPs), which are clean and low-cost. Moreover, the widely concerned Cr-complexes, considered as obstacles in the remediation process, can be effectively destroyed by AOPs. Cr self-catalysis is defined as Cr species is both substrate and catalyst. However, the full understanding of Cr self-catalysis, including the generation of intermediates Cr(IV)/Cr(V), the synergetic effects with co-existing ions, and the accumulation of toxic Cr(VI), remains a challenge for the practical application of Cr-initiated AOPs. In this review, relevant researches on Cr self-catalysis during Cr-initiated AOPs are summarized. Specifically, the Cr-Fenton-like reaction, Cr substituted materials, and Cr-sulfite reactions are explored as key mechanisms contributing to Cr self-catalysis. Moreover, Cr transformation processes, including synchronously Cr removal, Cr redox reactions, and Cr(VI) accumulation, in AOPs-based synergistic systems are systematically analyzed. Detailed approaches for the detection of active species in AOPs-based systems are also presented. The primary objective of this review is to explore the application of AOPs for Cr-containing wastewater remediation based on Cr self-catalysis, and provide fundamental insights and valuable information for future research on Cr-initiated AOPs.

关键词： Self-catalysis Cr-initiated AOPs Cr transformation Cr intermediates Cr-containing wastewater

Low-temperature chemistry in plasma-driven ammonia oxidative pyrolysis

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Green Energy & Environment 2024年第9期9卷 1477-1488页

作者： mingming Zhang Qi Chen Guangzhao Zhou Jintao Sun He Lin School of Mechanical Electronic and Control Engineering Beijing Jiaotong University School of Mechanical Engineering Shanghai Jiao Tong University

Ammonia is gaining increasing attention as a green alternative fuel for achieving large-scale carbon emission reduction. Despite its potential technical prospects, the harsh ignition conditions and slow flame propagation speed of ammonia pose significant challenges to its application in engines. Non-equilibrium plasma has been identified as a promising method, but current research on plasma-enhanced ammonia combustion is limited and primarily focuses on ignition characteristics revealed by kinetic models. In this study, low-temperature and low-pressure chemistry in plasma-assisted ammonia oxidative pyrolysis is investigated by integrated studies of steady-state GC measurements and mathematical simulation. The detailed kinetic mechanism of NH3decomposition in plasma-driven Ar/NH3and Ar/NH3/O2mixtures has been developed. The numerical model has good agreements with the experimental measurements in NH3/O2consumption and N2/H2generation, which demonstrates the rationality of modelling. Based on the modelling results, species density profiles, path flux and sensitivity analysis for the key plasmaproduced species such as NH2, NH, H2, OH, H, O, O（1D）, O2（a1△g）, O2（b1∑g+）, Ar*, H-, Ar+, NH3+, O2-in the discharge and afterglow are analyzed in detail to illustrate the effectiveness of the active species on NH3excitation and decomposition at low temperature and relatively higher E/N values. The results revealed that NH2, NH, H as well as H2are primarily generated through the electron collision reactions e + NH3→ e + NH2+ H, e + NH3→ e + NH + H2and the excited-argon collision reaction Ar*+ NH3+ H → Ar + NH2+ 2H, which will then react with highly reactive oxidative species such as O2*, O*, O, OH, and O2to produce stable products of NOx and H2O. NH3→ NH is found a specific pathway for NH3consumption with plasma assistance, which further highlights the enhanced kinetic effects.

关键词： Non-equilibrium plasma Ammonia fuel Oxidative pyrolysis Pathway flux analysis Sensitivity analysis

Experimental investigation on the anisotropy of friction property for dry and water-saturated rock

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Friction 2024年第9期12卷 2064-2082页

作者： Qing YANG mingming HE Jinrui ZHAO Mingchen DING Jing WANG State Key Laboratory of Eco-hydraulics in Northwest Arid Region Xi’an University of TechnologyXi’an 710048China China Communication Construction Company Mechanical and Electrical Engineering Co. Ltd.Beijing 100088China

Friction properties of rock are closely connected with the *** anisotropy of rock friction can provide a valuable assessment for geotechnical and geological *** this study,the rotary friction tests were conducted to analyze the water effect on the friction property and the friction anisotropy of the four types of *** drilling response model(DD-model)was employed to characterize the rotary friction behavior of the *** parameters of this model include the three types of friction parameters:1/ς,μ,and f,where 1/ςandμare constant,and f is a variable.A quantitative method is proposed for assessing the anisotropy of rock *** results of the rotary friction tests indicate that the relation between torque force and thrust force conforms to the *** changes of two friction constants 1/ςandμfrom dry state to water-saturated state suggest that the water effect on the friction strength of the rocks exhibits significant *** friction strength determined by the friction variable f increases first,then decreases,and finally stabilizes with the increasing of *** is an anisotropy index calculated by the proposed *** percentage difference of the average value of AIf between water-saturated and dry states shows the degree of the water effect on the friction anisotropy of the rocks,mudstone(MU)>granite(GR)>fine sandstone(FS)>argillaceous siltstone(AS).The quantitative model is hopefully constructed for characterizing the relation between the anisotropic friction strength of rock and the moisture state in future.

关键词： anisotropy rotary friction test drilling response model(DD-model) effective stress law

Transfer-learning multi-input multi-output equalizer for mode-division multiplexing systems

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Chinese Optics Letters 2024年第7期22卷 12-18页

作者： Tianfeng Zhao Feng Wen mingming Tan Baojian Wu Bo Xu Kun Qiu Key Laboratory of Optical Fiber Sensing and Communication Ministry of EducationUniversity of Electronic Science and Technology of ChinaChengdu 611731China Aston Institute of Photonics Technologies Aston UniversityBirmingham B47ETUK

We propose a transfer-learning multi-input multi-output(TL-MIMO)scheme to significantly reduce the required training complexity for converging the equalizers in mode-division multiplexing(MDM)*** on a built three-mode(LP01,LP11a,and LP11b)multiplexed experimental system,we thoughtfully investigate the TL-MIMO performances on the three-typed data,collecting from different sampling times,launching optical powers,and inputting optical signal-to-noise ratios(OSNRs).A dramatic reduction of approximately 40%–83.33%in the required training complexity is achieved in all three ***,the good stability of TL-MIMO in both the launched powers and OSNR test bands has also been proved.

关键词： mode division multiplexing multi-input multi-output transfer learning training complexity

Dynamic Modeling of Key Operating Parameters for Supercritical Circulating Fluidized Bed Units based on Data-Knowledge-Driven Method

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Journal of Thermal Science 2024年第3期33卷 1216-1230页

作者： YU Haoyang GAO mingming ZHANG Hongfu CHEN Jiyu LIU Jizhen YUE Guangxi The State Key Laboratory of Alternate Electrical Power System with Renewable Energy Sources School of Control and Computer EngineeringNorth China Electric Power UniversityBeijing102206China CHN Energy New Energy Technology Research Institute Co. Ltd.Beijing102209China Department of Energy and Power Engineering Tsinghua UniversityBeijing100084China

To address the pressing need for intelligent and efficient control of circulating fluidized bed(CFB)units,it is crucial to develop a dynamic model for the key operating parameters of supercritical circulating fluidized bed(SCFB)***,data-knowledge-driven dynamic model of bed temperature,load,and main steam pressure of the SCFB unit has been ***,a knowledge-driven method is employed to develop a dynamic model for key operating parameters of SCFB *** model parameters are determined based on the operating data of the unit and continuously optimized in real ***,Bidirectional Long Short-Term Memory combined with Convolutional Neural Network and Attention Mechanism is utilized to build the dynamic model of bed temperature,load,and main steam ***,a collaboration and integration method based on the critic weight method and the variation coefficient method is proposed to establish data-knowledge-driven model of key operating parameters for SCFB *** model displays great accuracy and fitting ability compared with other methods and effectively captures the dynamic characteristics,which can provide a research basis for the design of intelligent flexible control mode of SCFB unit.

关键词： circulating fluidized bed dynamic model data-knowledge-driven method deep learning power plant