2007

[128] Da Chen, Wensheng Cai, Xueguang Shao
An adaptive strategy for selecting representative calibration samples in the continuous wavelet domain for near-infrared spectral analysis
Analytical and Bioanalytical Chemistry, 2007, (387):1041-1048
[129] Lin Yi, Cai Wensheng, Shao Xueguang
Semiempirical study on the stability of single-walled carbon nanotubes with different sizes
Computers and Applied Chemistry, 2007, 24(1):97-102
[130] Xu Lei, Cai Wensheng, Shao Xueguang
Theoretical studies on the structures and stability of C80-C90 fullerenes
Computers and Applied Chemistry, 2007, 24(1):103-106
[131] Zhenqiang Su, Huixiao Hong, Roger Perkins, Xueguang Shao, Wensheng Cai, Weida Tong
Consensus analysis of multiple classifiers using non-repetitive variables: Diagnostic application to microarray gene expression data
Computational Biology and Chemistry, 2007, 31:48-56
[132] Li Yankun, Shao Xueguang, Cai Wensheng
Partial least squares regression method based on consensus modeling for quantitative analysis of near-infrared spectra
Chemical Journal of Chinese Universities, 2007, 28(2):246-249
[133] Longjiu Cheng, Wensheng Cai, Xueguang Shao
A conformational analysis method for understanding the energy landscapes of clusters
ChemPhysChem, 2007, 8(4): 569-577
[134] Yankun Li, Xueguang Shao, Wensheng Cai
A consensus least squares support vector regression (LS-SVR) for analysis of near-infrared spectra of plant samples
Talanta, 2007, 72(1): 217-222
[135] Xiaoli Yang, Wensheng Cai, Xueguang Shao
A dynamic lattice searching method with constructed core for optimization of large Lennard-Jones clusters
Journal of Computational Chemistry, 2007, 28(8):1427-1433
[136] Da Chen, Wensheng Cai, Xueguang Shao

 Representative subset selection in modified iterative predictor weighting (mIPW) PLS models for parsimonious multivariate calibration

Chemometrics and Intelligent Laboratory Systems, 2007, 87(2):312-318
[137] Xiaoli Yang, Wensheng Cai, Xueguang Shao

Structural variation of silver clusters from Ag13 to Ag160

Journal of Physical Chemistry A, 2007, 111(23):5048-5056
[138] Li Fujuan, Cai Wensheng, Shao Xueguang

Analysis of polyphenols in Tobacco using reversed-phase high performance liquid chromatography

Chinese Journal of Chromatography, 2007, 25(4):565-568
[139] Da Chen, Wensheng Cai, Xueguang Shao

Removing uncertain variables based on ensemble partial least squares

Analytica Chimica Acta, 2007, 598(1):19-26
[140] Lei Xu, Wensheng Cai and Xueguang Shao

Performance of the semiempirical AM1, PM3, MNDO, and tight-binding methods in comparison with DFT method for the large fullerenes C116C120

Journal of Molecular Structure: THEOCHEM, 2007, 817(1-3):35-41

[141]

Wei Wang, Wensheng Cai, Xueguang Shao

A post-modification approach to independent component analysis for resolution of overlapping GC/MS signals: from independent components to chemical components

Science in China Series B: Chemistry, 2007, 50(4):530-537

[142] Su Zhenqiang, Hong Huixiao, Tong Weida, Perkins Roger, Shao Xueguang, Cai Wensheng

Identification of differentially expressed genes using disjoint principal component analysis coupled with genetic algorithm

Chemical Journal of Chinese Universities, 2007, 28(9):1640-1644
[143] Lin Yi, Cai Wensheng, Shao Xueguang

 Improved tight-binding Monte Carlo method and its application in carbon nanopeapod

Chemical Journal of Chinese Universities, 2007, 28(9):1751-1755