复杂基质样品的稳健分析方法研究

20835002
2008
B0310.化学信息学与人工智能
邵学广
重点项目
教授
南开大学
200万元
化学计量学;复杂样品;多元校正;定量分析;红外光谱
2009-01-01到2012-12-31
  • 中英文摘要
  • 结题摘要
  • 结题报告
  • 项目成果
  • 项目参与人
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序号 标题 类型 作者
1 Quantitative Determination of the Components in Corn and Tobacco Samples by Using Near-Infrared Spectroscopy and Multiblock Partial Least Squares 期刊论文 Jing, Ming|Cai, Wensheng|Shao, Xueguang|
2 Free-Energy Landscape of the Helical Wrapping of a Carbon Nanotube by a Polysaccharide 期刊论文 Liu, Yingzhe|Chipot, Christophe|Shao, Xueguang|Cai, Wensheng|
3 Multiblock partial least squares regression based on wavelet transform for quantitative analysis of near infrared spectra 期刊论文 Jing, Ming|Cai, Wensheng|Shao, Xueguang|
4 Discrimination of plant samples using near-infrared spectroscopy with a principal component accumulation method 期刊论文 Wen, Yadong|Liu, Jingjing|Cai, Wensheng|Shao, Xueguang|
5 Detecting influential observations by cluster analysis and Monte Carlo cross-validation 期刊论文 Bian, Xihui|Cai, Wensheng|Shao, Xueguang|Chen, Da|Grant, Edward R.|
6 Multivariate calibration of near-infrared spectra by using influential variables 期刊论文 Shao, Xueguang|Zhang, Min|Cai, Wensheng|
7 Growth Pattern of Truncated Octahedra in Al-N (N <= 310) Clusters 期刊论文 Shao, Xueguang|Wu, Xia|Cai, Wensheng|
8 免疫算法:一种新的多组分重叠色谱信号的解析方法 期刊论文 邵学广|刘智超|蔡文生|
9 巯基微球富集用于近红外光谱同时定量分析微量汞(Ⅱ)和银(Ⅰ)离子 期刊论文 宁宇|蔡文生|邵学广|
10 Simultaneous determination of heavy metal ions in water using near-infrared spectroscopy with preconcentration by nano-hydroxyapatite 期刊论文 Ning, Yu|Li, Jihui|Cai, Wensheng|Shao, Xueguang|
11 Discrimination of industrial products by on-line near infrared spectroscopy with an improved dendrogram 期刊论文 Liu, Jing Jing|Xu, Heng|Cai, Wen Sheng|Shao, Xue Guang|
12 A practical approach for near infrared spectral quantitative analysis of complex samples using partial least squares modeling 期刊论文 Liu ZhiChao|Ma Xiang|Wen YaDong|Wang Yi|Cai WenSheng|Shao XueGuang|
13 Quantitative determination by temperature dependent near-infrared spectra 期刊论文 Shao, Xueguang|Kang, Jun|Cai, Wensheng|
14 Rapid and nondestructive analysis of pharmaceutical products using near-infrared diffuse reflectance spectroscopy 期刊论文 Li Pao|Du GuoRong|Cai WenSheng|Shao XueGuang|
15 An improved boosting partial least squares method for near-infrared spectroscopic quantitative analysis 期刊论文 Shao, Xueguang|Bian, Xihui|Cai, Wensheng|
16 Configuration of the Surface Atoms in Al-N (270 <= N <= 500) Clusters 期刊论文 Shao, Xueguang|Wu, Xia|Cai, Wensheng|
17 High-throughput approach for analysis of multicomponent gas chromatographic-mass spectrometric signals 期刊论文 Liu, Zhichao|Cai, Wensheng|Shao, Xueguang|
18 Structure, Stability, and Thermochemistry of the Fullerene Derivatives C64X6 (X = H, F, Cl) 期刊论文 Xu, Lei|Shao, Xueguang|Cai, Wensheng|
19 Predicting the coordination geometry for Mg2+ in the p53 DNA-binding domain: insights from computational studies 期刊论文 Wang, Teng|Shao, Xueguang|Cai, Wensheng|Xue, Yonglai|Wang, Shuai|Feng, Xizeng|
20 Wavelet unfolded partial least squares for near-infrared spectral quantitative analysis of blood and tobacco powder samples 期刊论文 Zhang, Min|Cai, Wensheng|Shao, Xueguang|
21 Multivariate calibration methods in near infrared spectroscopic analysis 期刊论文 Shao, Xueguang|Bian, Xihui|Liu, Jingjing|Zhang, Min|Cai, Wensheng|
22 An approach by using near-infrared diffuse reflectance spectroscopy and resin adsorption for the determination of copper, cobalt and nickel ions in dilute solution 期刊论文 Sheng, Nan|Cai, Wensheng|Shao, Xueguang|
23 疏水蛋白吸附碳纳米管的分子动力学模拟 期刊论文 刘英哲|蔡文生|邵学广|
24 Rapid determination of four tobacco specific nitrosamines in burley tobacco by near-infrared spectroscopy 期刊论文 Ma, Yanjun|Shao, Xueguang|Bai, Ruoshi|Du, Guorong|Ma, Li|He, Aijun|Li, Na|Yi, Xiaoli|Cai, Wensheng|Zhou, Jun|
25 Simultaneous determination of phenol and p-nitrophenol in wastewater using near-infrared diffuse reflectance spectroscopy with adsorption preconcentration 期刊论文 Zhang, Yan|Hao, Yong|Cai, Wensheng|Shao, Xueguang|
26 How Do alpha-Cyclodextrins Self-Organize on a Polymer Chain? 期刊论文 Liu, Peng|Chipot, Christophe|Shao, Xueguang|Cai, Wensheng|
27 Quantitative Analysis of Chromium(VI) in Dilute Solution by Using Adsorption and Diffuse Reflectance Near-infrared Spectroscopy 期刊论文 Shao Xueguang|Sheng Nan|Cai Wensheng|
28 环糊精的理论计算 期刊论文 王腾|蔡文生|邵学广|
29 Structural Characterization of Micelles Formed of Cholesteryl-Functionalized Cyclodextrins 期刊论文 Wang, Teng|Chipot, Christophe|Shao, Xueguang|Cai, Wensheng|
30 Quantitative determination by temperature dependent near-infrared spectra: A further study 期刊论文 Kang, Jun|Cai, Wensheng|Shao, Xueguang|
31 Solvent-Controlled Shuttling in a Molecular Switch 期刊论文 Liu, Peng|Chipot, Christophe|Shao, Xueguang|Cai, Wensheng|
32 Adsorption Behavior of Hydrophobin Proteins on Polydimethylsiloxane Substrates 期刊论文 Liu, Yingzhe|Wu, Ming|Feng, Xizeng|Shao, Xueguang|Cai, Wensheng|
33 Thermodynamic Insights into the Dynamic Switching of a Cyclodextrin in a Bistable Molecular Shuttle 期刊论文 Liu, Peng|Cai, Wensheng|Chipot, Christophe|Shao, Xueguang|
34 Weighted partial least squares regression by variable grouping strategy for multivariate calibration of near infrared spectra 期刊论文 Xu, Heng|Cai, Wensheng|Shao, Xueguang|
35 Simultaneous determination of mercury, lead and cadmium ions in water using near-infrared spectroscopy with preconcentration by thiol-functionalized magnesium phyllosilicate clay 期刊论文 Li, Jihui|Zhang, Yan|Cai, Wensheng|Shao, Xueguang|
36 Feasibility for quantitative determination of deoxyribonucleic acid by using near-infrared diffuse reflectance spectroscopy 期刊论文 Yang, Yafei|Tu, Jiarun|Cai, Wensheng|Shao, Xueguang|
37 Free Energy Calculations for Cyclodextrin Inclusion Complexes 期刊论文 Cai, Wen Sheng|Wang, Teng|Liu, Ying Zhe|Liu, Peng|Chipot, Christophe|Shao, Xue Guang|
38 Cancer classification based on microarray gene expression data using a principal component accumulation method 期刊论文 Liu JingJing|Cai WenSheng|Shao XueGuang|
39 Impact of Different Potentials on the Structures and Energies of Clusters 期刊论文 Ma, Zhinan|Cai, Wensheng|Shao, Xueguang|
40 Dynamic lattice searching methods for optimization of clusters 期刊论文 Shao XueGuang|Wu Xia|Cai WenSheng|
41 Electronic structures, stabilities, and spectroscopies of the fullerene derivatives C68X4 (X = H, F, Cl) 期刊论文 Xu, Lei|Shao, Xueguang|Cai, Wensheng|
42 Rapid analysis of multicomponent pesticide mixture by GC-MS with the aid of chemometric resolution 期刊论文 Miao, Lingni|Cai, Wensheng|Shao, Xueguang|
43 A variable differential consensus method for improving the quantitative near-infrared spectroscopic analysis 期刊论文 Du GuoRong|Cai WenSheng|Shao XueGuang|
44 Improving the Robustness and Stability of Partial Least Squares Regression for Near-infrared Spectral Analysis 期刊论文 Shao Xueguang|Chen Da|Xu Heng|Liu Zhichao|Cai Wensheng|
45 The effects of 7-dehydrocholesterol on the structural properties of membranes 期刊论文 Liu, Yingzhe|Chipot, Christophe|Shao, Xueguang|Cai, Wensheng|
46 Simultaneous Identification and Quantitative Determination of Amino Acids in Mixture by NMR Spectroscopy Using Chemometric Resolution 期刊论文 Shao, Xueguang|Miao, Lingni|Liu, Zhichao|Liu, Huili|Cai, Wensheng|
47 Online near-Infrared Spectroscopy Combined with Alternating Trilinear Decomposition for Process Analysis of Industrial Production and Quality Assurance 期刊论文 Liu, Jingjing|Ma, Xiang|Wen, Yadong|Wang, Yi|Cai, Wensheng|Shao, Xueguang|
48 A wavelength selection method based on randomization test for near-infrared spectral analysis 期刊论文 Xu, Heng|Liu, Zhichao|Cai, Wensheng|Shao, Xueguang|
49 Rapid Determination of Metabolites in Bio-fluid Samples by Raman Spectroscopy and Optimum Combinations of Chemometric Methods 期刊论文 Bian Xihui|Chen Da|Cai Wensheng|Grant, Edward|Shao Xueguang|
50 Application of Near-infrared Spectroscopy in Micro Inorganic Analysis 期刊论文 Shao Xueguang|Ning Yu|Liu Fengxia|Li Jihui|Cai Wensheng|
51 Extraction of chemical information from complex analytical signals by a non-negative independent component analysis 期刊论文 Shao, Xueguang|Liu, Zhichao|Cai, Wensheng|
52 Classification and quantitative analysis of Azithromycin tablets by Raman spectroscopy and chemometrics 期刊论文 Li Yan|Du GuoRong|Cai WenSheng|Shao XueGuang|
53 Resolving multi-component overlapping GC-MS signals by immune algorithms 期刊论文 Shao, Xueguang|Liu, Zhichao|Cai, Wensheng|
54 A dynamic lattice searching method with rotation operation for optimization of large clusters 期刊论文 Wu, Xia|Cai, Wensheng|Shao, Xueguang|
55 Edge effects control helical wrapping of carbon nanotubes by polysaccharides 期刊论文 Liu, Yingzhe|Chipot, Christophe|Shao, Xueguang|Cai, Wensheng|
56 Solubilizing Carbon Nanotubes through Noncovalent Functionalization. Insight from the Reversible Wrapping of Alginic Acid around a Single-Walled Carbon Nanotube 期刊论文 Liu, Yingzhe|Chipot, Christophe|Shao, Xueguang|Cai, Wensheng|
57 Self-assembly behavior of beta-cyclodextrin and imipramine. A Free energy perturbation study 期刊论文 Sun, Tingting|Shao, Xueguang|Cai, Wensheng|
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