化学信息学实验室
2015年发表的部分论文目录
2019
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2018
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2017
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2016
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2015
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2014
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2013
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2012
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2011
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2010
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2009
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2008
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2007
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2006
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2005
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2004
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2003
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2002
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2001
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2000
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1999
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1998
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1997
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1996
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1995
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Books
2015
[1] |
Ruifeng Shan, Yue Zhao, Mengli Fan, Xiuwei Liu, Wensheng Cai, Xueguang Shao |
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Multilevel analysis of temperature dependent near-infrared spectra |
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Talanta, 2015, 131: 170-174 |
[2] |
Haohao Fu, Jeffrey Comer, Wensheng Cai, Christophe Chipot |
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Sonoporation at small and large length scales: effect of cavitation Bubble Collapse on Membranes |
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Journal of Physical Chemistry Letters, 2015, 6, 413-418 |
[3] |
何佳, 冯喜增, 邵学广, 蔡文生 |
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疏水蛋白在云母表面的吸附 |
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高等学校化学学报, 2015, 36(1): 110-115 |
[4] |
刘言, 蔡文生, 邵学广 |
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大数据与化学数据挖掘 |
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科学通报, 2015, 60(8): 694-703 |
[5] |
刘言, 蔡文生, 邵学广 |
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近红外光谱分析方法研究: 从传统数据到大数据 |
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科学通报, 2015, 60(8): 704-713 |
[6] |
Zhenzhen Xia, Wensheng Cai, Xueguang Shao |
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Rapid discrimination of slimming capsules based on illegal additives by electronic nose and flash gas chromatography |
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Journal of separation science, 2015, 38( 4):621-625 |
[7] |
Pao Li, Wensheng Cai, Xueguang Shao |
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Improved inductively coupled plasma optical emission spectroscopy analysis of trace elements in complex matrices by chemometric resolution |
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Journal of Analytical Atomic Spectrometry, 2015, 30(4): 936-940 |
[8] |
樊梦丽, 赵越, 刘言, 蔡文生, 邵学广 |
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近红外光谱水光谱组学 |
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化学进展, 2015, 27(2-3) : 242-250 |
[9] |
Ganghui Chu, Wensheng Cai, Xueguang Shao |
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Preparation of 4-butylaniline-bonded attapulgite for pre-concentration of bisphenol A in trace quantity |
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Talanta, 2015, 136:29-34 |
[10] |
Ganghui Chu, Wensheng Cai, Xueguang Shao |
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Preparation of 4-butylaniline-bonded silica gel for the solid-phase extraction of flavone glycosides |
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Journal of Separation Science, 2015, 38(7): 1149-1155 |
[11] |
Zhenzhen Xia, Wensheng Cai, Xueguang Shao |
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Predicting Chromatographic Retention Time of C-10-Chlorinated Paraffins in Gas Chromatography-Mass Spectrometry Using Quantitative Structure Retention Relationship |
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Chemical Research in Chinese Universities, 31(2): 192-197 |
[12] |
Pao Li, Wensheng Cai, Xueguang Shao |
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Standard signal extraction for analyzing target analytes in real samples with complex matrices |
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Journal of Chemometrics, 2015, 29(5): 300-308 |
[13] |
Yihang Zeng, Wensheng Cai, Xueguang Shao |
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Quantitative analysis of 17 amino acids in tobacco leaves using amino acid analyzer and chemometric resolution |
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Journal of separation sciences, 2015, 38(12): 2053-2058 |
[14] |
Xiaoyong Li, Zhihong Xu, Wensheng Cai, Xueguang Shao |
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Filter design for molecular factor computing using wavelet functions |
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Analytica Chimica Acta, 2015, 880: 26-31 |
[15] |
Ying Liu, Christophe Chipot, Xueguang Shao, Wensheng Cai |
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What causes tumbling of altro-alpha-CD derivatives? Insight from computer simulations |
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RSC Advances, 2015, 5(71): 57309-57317 |
[16] |
Pao Li, Wensheng Cai, Xueguang Shao |
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Generalized window factor analysis for selective analysis of the target component in real samples with complex matrices |
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Journal of Chromatography A, 2015, 1407: 203-207 |
[17] |
Zhihong Xu, Yan Liu, Xiaoyong Li, Wensheng Cai, Xueguang Shao |
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Discriminant analysis of Chinese patent medicines based on near-infrared spectroscopy and principal component discriminant transformation |
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Spectrochimica Acta Part A-Molecular and Biomolecular Spectroscopy, 2015, 149 : 985-990 |
[18] |
Zhenzhen Xia, Yan Liu, Wensheng Cai, Xueguang Shao |
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Band target entropy minimization for retrieving the information of individual components from overlapping chromatographic data |
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Journal of Chromatography A, 2015, 1411 : 110-115 |
[19] |
Peng Liu, Xueguang Shao, Wensheng Cai |
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Deciphering the mechanism involved in the switch on/off of molecular pistons |
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Chinese Journal of Chemistry, 2015, 33(10): 1199-1205 |
[20] |
Haohao Fu, Christophe Chipot, Xueguang Shao, Wensheng Cai |
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Why do the structural properties of complexes formed by glucans and carbon nanotubes differ so much? |
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RSC Advances, 2015, 5(116): 95682-95689 |
[21] |
汪双双, 刘鹏, 蔡文生, 邵学广 |
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链状结构的疏水性对溶剂控制的轮烷穿梭行为的影响 |
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高等学校化学学报, 2015, 36(11) : 2211-2219 |
[22] |
Yan Liu, Wensheng Cai, Xueguang Shao |
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Designing classification filters for integrated sensing and processing using optimal discriminant vectors |
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Chemometrics and Intelligent Laboratory Systems 149 (2015) : 22-27 |
[23] |
Xiaoyong Li, Wensheng Cai, Xueguang Shao |
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Correcting multivariate calibration model for near infrared spectral analysis without using standard samples |
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Journal of Near Infrared Spectroscopy, 2015, 23(5) : 285-291 |
[24] |
王家俊, 李正风, 王萝萍, 卞希慧, 蔡文生, 邵学广 |
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蒙特卡洛交叉验证用于偏最小二乘建模数据质量的评价 |
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计算机与应用化学, 2015, 32(12) : 1530-1536 |