化学信息学实验室
2012年发表的部分论文目录
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[1] |
Xueguang
Shao, Min Zhang and Wensheng Cai |
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Multivariate
calibration of near-infrared spectra by using influential variables |
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Analytical Methods, 2012, 4:467-473 |
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[2] |
Peng
Liu, Christophe Chipot, Xueguang Shao, Wensheng Cai |
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Solvent-controlled
shuttling in a molecular switch |
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Journal of Physical Chemistry C,
2012, 116:4471-4476 |
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[3] |
Xia Qin,
Zhiying Miao, Yuxin Fang, Di Zhang, Jia Ma, Lu Zhang, Qiang Chen, Xueguang
Shao |
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Preparation
of dendritic nanostructures of silver and their characterization for
electroreduction |
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Langmuir, 2012,
28 (11):5218-5226 |
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[4] |
Yingzhe Liu,
Christophe Chipot, Xueguang Shao, Wensheng Cai |
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Edge effects control helical wrapping of carbon nanotubes by
polysaccharides |
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Nanoscale, 2012,
4:2584-2589 |
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[5] |
Xueguang
Shao , Guorong Du, Ming Jing, Wensheng Cai |
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Application of latent projective graph in variable selection
for near infrared spectral analysis |
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Chemometrics and Intelligent Laboratory Systems,
2012, 114:44-49 |
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[6] |
Yanjun
Ma, Ruoshi Bai, Guorong Du, Li Ma, Aijun He, Na Li, Xiaoli Yi, Wensheng Cai,
Jun Zhou, Xueguang Shao |
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Rapid determination of four tobacco specific nitrosamines in
burley tobacco by near-infrared spectroscopy |
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Analytical Methods, 2012,
4 (5):1371-1376 |
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[7] |
宁宇,
蔡文生, 邵学广 |
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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 |
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高等学校化学学报, 2012,
33 (4):673-677 |
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[8] |
Yu Ning,
Jihui Li, Wensheng Cai, Xueguang Shao |
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Simultaneous determination of heavy metal ions in water using
near-infrared spectroscopy with preconcentration by nano-hydroxyapatite |
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Spectrochimica Acta Part
A: Molecular and Biomolecular Spectroscopy, 2012, 96:289-294 |
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[9] |
Chunying
Gao, Yuanyuan Guo, Jia He, Ming Wu, Yang Liu, Zhongliang Chen, Wensheng Cai,
Yanlian Yang , Chen Wang, Xizeng Feng |
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L-3,4-dihydroxyphenylalanine-collagen modified PDMS surface
for controlled cell culture |
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Journal of Materials Chemistry,
2012, 22(21):10763-10770 |
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[10] |
Yi Wang,
Xiang Ma, Yadong Wen, Jingjing Liu, Wensheng Cai, Xueguang Shao |
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Discrimination of plant samples using near-infrared
spectroscopy with a principal component accumulation method |
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Analytical Methods, 2012,
4(9):2893-2899 |
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[11] |
Yafei
Yang, Jiarun Tu, Wensheng Cai, Xueguang Shao |
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Feasibility for quantitative determination of deoxyribonucleic
acid by using near-infrared diffuse reflectance spectroscopy |
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Talanta, 2012,
99: 871-874 |
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[12] |
Pao Li,
Guorong Du, Wensheng Cai, Xueguang Shao |
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Rapid and nondestructive analysis of pharmaceutical products using
near-infrared diffuse reflectance spectroscopy |
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Journal of Pharmaceutical and Biomedical
Analysis, 2012,
70: 288-294 |
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[13] |
GuoRong Du,
Wensheng Cai, Xueguang Shao |
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A variable differential consensus method for improving the
quantitative near-infrared spectroscopic analysis |
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Science China Chemistry, 2012, 55(9): 1946-1952 |
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[14] |
Yingzhe
Liu, Ming Wu, Xizeng Feng, Xueguang Shao, Wensheng Cai |
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Adsorption Behavior of Hydrophobin Proteins on
Polydimethylsiloxane Substrates |
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Journal of Physical Chemistry B, 2012, 116(40): 12227-12234 |
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[15] |
刘英哲,蔡文生,邵学广 |
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疏水蛋白吸附碳纳米管的分子动力学模拟 |
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高等学校化学学报, 2012, 33(9): 2013-2018 |
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[16] |
邵学广,宁宇,刘凤霞,李积慧,蔡文生 |
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近红外光谱在无机微量成分分析中的应用 |
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化学学报, 2012, 70(20): 2109-2114 |
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[17] |
Peng
Liu, François Dehez, Wensheng Cai, and Christophe Chipot |
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A Toolkit for the Analysis of Free-Energy Perturbation
Calculations |
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Journal of Chemical Theory and Computation, 2012, 8(8): 2606–2616 |
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[18] |
Peng
Liu, Christophe Chipot, Xueguang Shao, and Wensheng Cai |
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How Do alpha-Cyclodextrins Self-Organize on a Polymer Chain? |
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Journal of Physical Chemistry C, 2012, 116(33): 17913–17918 |
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[19] |
Yun-Fang
Jia, Chun-Ying Gao, Jia He, Dao-Fu Feng, Ke-Li Xing, Ming Wu, Yang Liu,
Wen-Sheng Cai and Xi-Zeng Feng |
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Unlabeled multi tumor marker detection system based on
bioinitiated light addressable potentiometric sensor |
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Analyst, 2012, 137: 3806-3813 |
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