[199] Weimin Guo, Wensheng Cai, Xueguang Shao, Zhongxiao Pan
Application of genetic stochastic resonance algorithm to quantitative structure-activity relationship study
Chemometrics and Intelligent Laboratory Systems, 2005,75(2):181-188
[200] Longjiu Cheng, Wensheng Cai, Xueguang Shao
Geometry optimization and conformation analysis of (C60)N clusters by using a dynamic lattice-searching method
ChemPhysChem, 2005, 6(2):261-266
[201] Longjiu Cheng, Wensheng Cai, Xueguang Shao
An energy-based perturbation and a taboo strategy for improving the searching ability of stochastic structural optimization methods
Chemical Physics Letters, 2005, 404(1-3):182-186
[202] 王国庆,邵学广
分析化学2005, 33(2):191-194
[203] Da Chen, Xueguang Shao, Bin Hu, Qingde Su
Simultaneous wavelength selection and outlier detection in multivariate regression of near-infrared spectra
Analytical Sciences, 2005, 21(2):161-166
[204] Huan Zhan, Wensheng Cai, Qingxiang Guo, Xueguang Shao
A theoretical investigation of small Si/C clusters by a combination of MM and QM method
Chemical Physics Letters, 2005, 405(1-3):97-102
[205] 苏振强,徐佳维,蔡文生,邵学广
基于Globus ToolkitSunTM ONE Grid Engine构建计算网格
计算机与应用化学2005, 22(2):81-84
[206] Da Chen, Bin Hu, Xueguang Shao, Qingde Su
A new hybrid strategy for constructing a robust calibration model for near-infrared spectral analysis
Analytical and Bioanalytical Chemistry, 2005, 381(3):795-805
[207] 王伟,蔡文生,邵学广
化学进展2005, 17(2):336-342   
[208] Wensheng Cai, Lei Xu, Nan Shao, Xueguang Shao, Qingxiang Guo
An efficient approach for theoretical study on the low-energy isomers of large fullerenesC90-C140
The Journal of Chemical Physics, 2005, 122(18), 184318
[209] Wensheng Cai, Xuexia Yao, Xueguang Shao, Zhongxiao Pan
Bimodal complexations of steroids with cyclodextrins by a flexible docking algorithm
Journal of Inclusion Phenomena and Macrocyclic Chemistry, 2005, 51: 4151
[210] Xueguang Shao, Yuhong Xiang, Wensheng Cai
Structural Transition from Icosahedra to Decahedra of Large Lennard-Jones Clusters
Journal of Physical Chemistry A, 2005, 109(23):5193-5197
50 free electronic reprints are being offered at:
[211] Wensheng Cai, Yanmin Yu, Xueguang Shao
Chiral recognition of aromatic compounds by β-cyclodextrin based on bimodal complexation
Journal of Molecular Modelling, 2005, 11(3):186-193
[212] Xueguang Shao, Xiaomeng Liu, and Wensheng Cai
Structural optimization of silver clusters up to 80 atoms with Gupta and Sutton-Chen potential
Journal of Chemical Theory and Computation, 2005, 1(4):762-768

50 free electronic reprints are being offered at:
[213] 蔡文生,林翼,邵学广
化学进展, 2005, 17(4):588-596
[214] 吴荣晖, 邵学广
分析化学2005, 33 (7): 1010-1012
[215] 侯振雨, 王国庆, 蔡文生, 邵学广
计算机与应用化学, 2005, 22(9):714-716
[216] Jinchao Shen, Xueguang Shao
A comparison of accelerated solvent extraction, Soxlet extraction, and ultrasonic-assisted extraction for analysis of terpenoids and sterols in tobacco
Analytical and Bioanalytical Chemistry, 2005, 383(6):1003-1008