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Acta Pharmaceutica Sinica B 2015年第5期5卷 482-486页

作者： Yuqiao Song Jie Liao Cheng Zha Bin Wang charles C.liu Medical Experiment and Analysis Center of PLA General Hospital ASPEC Technologies Limited Beijing

A novel method for the simultaneous determination of 3-nitrotyrosine(NT) and 3-chlorotyrosine(CT) in human plasma has been developed based on direct analysis in real time–tandem mass spectrometry(DART–MS/MS). Analysis was performed in the positive ionization mode using multiple reaction monitoring(MRM) of the ion transitions at m/z 216.2/170.1 for CT, m/z 227.2/181.1 for NT and m/z 230.2/184.2 for the internal standard, d^3-NT. The assay was linear in the ranges 0.5–100 μg/m L for CT and 4–100 μg/m L for NT with corresponding limits of detection of 0.2 and 2 μg/m L. Intra- and inter-day precisions and accuracies were respectively <15% and ±15%. Matrix effects were also evaluated. The method is potentially useful for high throughput analysis although sensitivity needs to be improved before it can be applied in clinical research.

关键词： 3-Nitrotyrosine 3-Chlorotyrosine Determintion DART–MS/MS Human plasma

Combination of Solid-Phase Micro-Extraction and Direct Analysis in Real Time-Fourier Transform Ion Cyclotron Resonance Mass Spectrometry for Sensitive and Rapid Analysis of 15 Phthalate Plasticizers in Beverages

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中国化学:英文版 2015年第2期33卷 213-219页

作者： Mengxi Wu Haoyang Wang Guoqing Dong Brian D.Musselman charles C.liu Yinlong Guo Shanghai Mass Spectrometry Center Shanghai Institute of Organic ChemistryChinese Academy of SciencesShanghai 200032China IonSense Inc.999 BroadwaySuite 404SaugusMA 01906USA ASPEC Technologies Limited Room 1506RunFengDeShang Bldg ANo.60 An Li LuChaoyang DistrictBeijing 100101China

A method for rapid identification and quantification of phthalate plasticizers in beverages was developed.A number of 15 phthalate plasticizers which covered all the phthalates concerned in the US Consumer Product Safety Improvement Act(CPSIA),European Union legislations and Chinese national standards(GB)were *** a combined solid-phase micro-extraction(SPME)and direct analysis in real time mass spectrometry(DART-MS)approach,phthalates at sub-ng•mL^(−1)levels can be qualitatively and quantitatively analyzed in a short *** use of ultrahigh-resolving power and the accurate mass measurement capacity naturally provided by Fourier transform ion cyclotron resonance mass spectrometry(FT-ICR-MS)minimizes the matrix interferences and thus enables the evaluation of phthalates in a complex matrix without extensive sample handlings or *** limits of quantification(LOQs)were estimated to be at 0.3-5.0 ng•mL^(−1),lower than the Maximum Residue Limit(MRL)regulated by the European Union legislations(2007/19/EC)in foods,beverages,food packaging and toys(0.3-30 ng•mL^(−1)).This rapid and easy-to-use SPME-DART-FT-ICR-MS method provided a relatively high-throughput and powerful analytical approach for quick testing and screening phthalates in beverages and water samples to ensure food safety.

关键词： solid-phase micro-extraction direct analysis in real time Fourier transform ion cyclotron resonance mass spectrometry phthalates

Rapid Screening of Nine Illicit Drugs in Human Blood and Urine by Direct Analysis in Real‑Time Mass Spectrometry

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Journal of Forensic Science and Medicine 2019年第3期5卷 136-140页

作者： Ying Zhang Wenfang Zhang Guobin Xin Li liu Xiaokun Duan charles liu Forensic Science Service of Beijing Public Security Bureau Key Laboratory of Forensic ToxicologyMinistry of Public SecurityBeijingChina ASPEC Technologies Limited BeijingChina

We aimed to establish for the rapid detection of morphine,O6‑monoacetylmorphine,heroin,codeine,cocaine,methamphetamine,ketamine,methadone,and dolantin in human blood and urine by direct analysis in real‑time coupled with tandem mass spectrometry(DART‑MS/MS).These samples were extracted by acetonitrile‑methanol(V/V=4:1),using DART 12 Dip‑it automatic sampling *** were injected at 400℃,and analyzed by positive ion and multiple reaction monitoring *** detection limits of morphine,O6‑Monoacetylmorphine,heroin,codeine,cocaine,methamphetamine,ketamine,methadone,and dolantin were 100,50,50,100,20,20,10,1,and 0.01 ng/mL,*** practical cases contained methamphetamine,codeine,cocaine,and O6‑monoacetylmorphine were detected accurately and *** method has the advantages of high sensitivity and good *** sample processing is simple and can be analyzed in a short *** method is suitable for the analysis of morphine,O6‑monoacetylmorphine,heroin,codeine,cocaine,methamphetamine,ketamine,methadone,and dolantin in some practical cases.

关键词： Direct analysis in real‑time mass spectrometry forensic toxicological analysis illicit drugs rapid screening

Alternative splicing of the PECTINESTERASE gene encoding a cell wall-degrading enzyme affects postharvest softening in grape

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Journal of Integrative Agriculture 2024年第3期23卷 863-875页

作者： Hainan liu Maosong Pei charles Ampomah-Dwamena Yaxin Shang Yihe Yu Tonglu Wei Qiaofang Shi Dalong Guo College of Horticulture and Plant Protection Henan University of Science and TechnologyLuoyang 471000China Henan Engineering Technology Research Center of Quality Regulation and Control of Horticultural Plants Luoyang 471000China The New Zealand Institute for Plant&Food Research Limited(PFR) Auckland 1010New Zealand

The firmness of table grape berries is a crucial quality parameter. Despite extensive research on postharvest fruit softening, its precise molecular mechanisms remain elusive. To enhance our comprehension of the underlying molecular factors, we initially identified differentially expressed genes(DEGs) by comparing the transcriptomes of folic acid(FA)-treated and water-treated(CK) berries at different time points. We then analyzed the sequences to detect alternatively spliced(AS) genes associated with postharvest softening. A total of 2,559 DEGs were identified and categorized into four subclusters based on their expression patterns, with subcluster-4 genes exhibiting higher expression in the CK group compared with the FA treatment group. There were 1,045 AS-associated genes specific to FA-treated berries and 1,042 in the CK-treated berries, respectively. Gene Ontology(GO) annotation indicated that the AS-associated genes in CK-treated berries were predominantly enriched in cell wall metabolic processes,particularly cell wall degradation processes. Through a comparison between treatment-associated AS genes and subcluster-4 DEGs, we identified eight genes, including Pectinesterase 2(VvPE2, Vitvi15g00704), which encodes a cell wall-degrading enzyme and was predicted to undergo an A3SS event. The reverse transcription polymerase chain reaction further confirmed the presence of a truncated transcript variant of VvPE2 in the FA-treated *** study provides a comprehensive analysis of AS events in postharvest grape berries using transcriptome sequencing and underscores the pivotal role of VvPE2 during the postharvest storage of grape berries.

关键词： grape postharvest softening folic acid alternative splicing Pectinesterase 2 alternative 3'splice site(A3SS)

Simultaneous determination of typical toxic aldehydes formed during food frying and digestion using isotope dilution UHPLC-QqQ-MS/MS

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Grain & Oil Science and Technology 2024年第1期7卷 42-49页

作者： Feng Wang Yun Cui Dongjie liu charles Brennan Soottawat Benjakul Weiwei Cheng Gengsheng Xiao Lukai Ma Key Laboratory of Green Processing and Intelligent Manufacturing of Lingnan Specialty Food of Ministry and Rural Affairs College of Light Industry and FoodZhongkai University of Agriculture and EngineeringGuangzhou 510225China School of Science Royal Melbourne Institute of Technology UniversityMelbourneAustralia International Center of Excellence in Seafood Science and Innovation Faculty of Agro-IndustryPrince of Songkla UniversitySongkhla 90110Thailand College of Food Science and Technology Zhejiang University of TechnologyHangzhou 310014China

An isotope dilution ultra-performance liquid chromatography-triple quadrupole mass spectrometry method was developed to simultaneously detect two typical kinds ofα,β-unsaturated aldehydes,namely 4-hydroxy-2-hexenal(4-HHE)and 4-hydroxy-2-nonenal(4-HNE),in *** proposed method exhibited a linear range of 10-1000 ng/mL with a limit of detection of 0.1-2.0 ng/g and a limit of quantification of 0.3-5.0 ng/*** recovery rates of these typical toxic aldehydes(i.e.,4-HHE,4-HNE)and their d3-labeled analogues were 91.54%-105.12%with a low matrix ***,this proposed method was successfully applied to a real frying system and a simulated digestion system,wherein the contents of 4-HHE and 4-HNE were determined for ***,the obtained results provide strong support for further research into the production of 4-HHE and 4-HNE resulting from foods during oil digestion and frying.

关键词： UHPLC-QqQ-MS/MS 4-Hydroxy-2-hexenal 4-Hydroxy-2-nonenal Frying Simulated digestion

Selective Hydrodeoxygenation of Lignin-Derived Vanillin via Hetero-Structured High-Entropy Alloy/Oxide Catalysts

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Energy & Environmental Materials 2024年第3期7卷 202-210页

作者： Yan Sun Kaili Liang Ren Tu Xudong Fan charles Q.Jia Zhiwen Jia Yingnan Li Hui Yang Enchen Jiang Hanwen liu Yonggang Yao Xiwei Xu Key Laboratory for Biobased Materials and Energy of Ministry of Education College of Materials and EnergySouth China Agricultural UniversityGuangzhou 510640China Department of Chemical Engineering and Applied Chemistry University of Toronto200 College StreetToronto ON M5S3E5Canada State Key Laboratory of Materials Processing and Die&Mould Technology School of Materials Science and EngineeringHuazhong University of Science and TechnologyWuhan 430074China

The chemoselective hydrodeoxygenation of natural lignocellulosic materials plays a crucial role in converting biomass into value-added *** their complex molecular structures often require multiple active sites synergy for effective activation and achieving high ***,it is reported that a high-entropy alloy(HEA)on high-entropy oxide(HEO)hetero-structured catalyst for highly active,chemoselective,and robust vanillin *** heterogenous HEA/HEO catalysts were prepared by thermal reduction of senary HEOs(NiZnCuFeAlZrO_(x)),where exsolvable metals(e.g.,Ni,Zn,Cu)in situ emerged and formed randomly dispersed HEA nanoparticles anchoring on the HEO *** catalyst exhibits excellent catalytic performance:100%conversion of vanillin and 95%selectivity toward high-value 2-methyl-4 methoxy phenol at low temperature of 120℃,which were attributed to the synergistic effect among HEO matrix(with abundant oxygen vacancies),anchored HEA nanoparticles(having excellent hydrogenolysis capability),and their intimate hetero-interfaces(showing strong electron transferring effect).Therefore,our work reported the successful construction of HEA/HEO heterogeneous catalysts and their superior multifunctionality in biomass conversion,which could shed light on catalyst design for many important reactions that are complex and require multifunctional active sites.

关键词： biomass conversion heterogeneous catalysts high-entropy oxide high-entropy alloys lignin pyrolysis

Prediction of Porous Media Fluid Flow with Spatial Heterogeneity Using Criss-Cross Physics-Informed Convolutional Neural Networks

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Computer Modeling in Engineering & Sciences 2024年第2期138卷 1323-1340页

作者： Jiangxia Han Liang Xue Ying Jia Mpoki Sam Mwasamwasa Felix Nanguka charles Sangweni Hailong liu Qian Li State Key Laboratory of Petroleum Resources and Prospecting China University of PetroleumBeijing102249China Department of Oil-Gas Field Development Engineering College of Petroleum EngineeringChina University of PetroleumBeijing102249China Exploration Production Research Institute SinopecBeijing102249China Ministry of Energy Tanzania Petroleum Development CorporationTowerDar es Salaam2774Tanzania Ministry of Energy Building Petroleum Upstream Regulatory Authority in Tanzania(PURA)Dar es Salaam11439Tanzania

Recent advances in deep neural networks have shed new light on physics,engineering,and scientific *** the data-centered viewpoint with physical simulation is one of the research *** physicsinformedneural network(PINN)is currently the most general framework,which is more popular due to theconvenience of constructing NNs and excellent generalization *** automatic differentiation(AD)-basedPINN model is suitable for the homogeneous scientific problem;however,it is unclear how AD can enforce fluxcontinuity across boundaries between cells of different properties where spatial heterogeneity is represented bygrid cells with different physical *** this work,we propose a criss-cross physics-informed convolutionalneural network(CC-PINN)learning architecture,aiming to learn the solution of parametric PDEs with spatialheterogeneity of physical *** achieve the seamless enforcement of flux continuity and integration ofphysicalmeaning into CNN,a predefined 2D convolutional layer is proposed to accurately express transmissibilitybetween adjacent *** efficacy of the proposedmethodwas evaluated through predictions of several petroleumreservoir problems with spatial heterogeneity and compared against state-of-the-art(PINN)through numericalanalysis as a benchmark,which demonstrated the superiority of the proposed method over the PINN.

关键词： Physical-informed neural networks(PINN) flow in porous media convolutional neural networks spatial heterogeneity machine learning

A machine learning-based calibration method for strength simulation of self-piercing riveted joints

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Advances in Manufacturing 2024年第3期12卷 465-483页

作者： Yu-Xiang Ji Li Huang Qiu-Ren Chen charles K.S.Moy Jing-Yi Zhang Xiao-Ya Hu Jian Wang Guo-Bi Tan Qing liu Key Laboratory for Light-weight Materials Nanjing Tech UniversityNanjing210009People’s Republic of China Design School Xi’an Jiaotong-Liverpool UniversitySuzhou215123JiangsuPeople’s Republic of China Materials Bigdata and Applications Division Materials Academy JitriSuzhou215131JiangsuPeople’s Republic of China School of Mechanical Engineering Nanjing University of Science and TechnologyNanjing210094People’s Republic of China

This paper presents a new machine learning-based calibration framework for strength simulation models of self-piercing riveted(SPR)*** simulations were conducted through the integrated modeling of SPR joints from process to performance,while physical quasi-static tensile tests were performed on combinations of DP600 high-strength steel and 5754 aluminum alloy sheets under lap-shear loading conditions.A sensitivity study of the critical simulation parameters(e.g.,friction coefficient and scaling factor)was conducted using the controlled variables method and Sobol sensitivity analysis for feature ***,machine-learning-based surrogate models were used to train and accurately represent the mapping between the detailed joint profile and its load-displacement *** of the simulation model is defined as a dual-objective optimization task to minimize errors in key load displacement features between simulations and experiments.A multi-objective genetic algorithm(MOGA)was chosen for *** three combinations of SPR joints illustrated the effectiveness of the proposed framework,and good agreement was achieved between the calibrated models and experiments.

关键词： Machine learning Self-piercing riveting(SPR) Sensitivity analysis Multi-objective optimization

美国密歇根州立大学“全面国际化”发展战略的经验及启示

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教育探索 2016年第10期 134-138页

作者：朱宁洁朱俊生陈蕾 charles liu 首都经济贸易大学发展规划处北京100070 首都经济贸易大学劳动经济学院北京100070 首都经济贸易大学财政税务学院北京100070 密歇根州立大学国际学生和学者办公室美国东兰辛48823

密歇根州立大学是美国公立大学成功实施国际化战略的典范,近年来学校所实施的"全面国际化"发展战略更是对大学国际化理论和实践产生了一定的影响。"全面国际化"发展战略的核心内涵是国际化对人才培养、科学研究和社会服务这些大学核心... 详细信息

密歇根州立大学是美国公立大学成功实施国际化战略的典范,近年来学校所实施的"全面国际化"发展战略更是对大学国际化理论和实践产生了一定的影响。"全面国际化"发展战略的核心内涵是国际化对人才培养、科学研究和社会服务这些大学核心功能及师资建设的全面渗透;健全的组织体系是战略实施的基本保障;全校参与、形成合力是学校国际化的显著特色。密歇根州立大学"全面国际化"的发展战略启示我国要遵循优先地位与着眼未来原则制定国际化战略,这一战略应服务于学校的核心职能,并赋予有效的组织保障。

关键词：大学全面国际化发展战略密歇根州立大学

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关于膜污染研究的几点思考

关于膜污染研究的几点思考