A Publication List of the Laboratory Since 1995
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2004
| [1] | Xueguang Shao, Haiyan Jiang, Wensheng Cai |
| Parallel random tunneling algorithm for structural optimization of Lennard-Jones clusters up to N=330 | |
| Journal of Chemical Information and Computer Sciences, 2004, 44(1):193-199 | |
| [2] | Zhuang Yadong, Zhang Ying, Wang Fang, Shao Xueguang |
| Analysis of polyphenols in cigarettes | |
| Tobacco Science and Technology (Chinese Journal), 2004, 1:23-26 | |
| [3] | Xueguang Shao, Fang Wang, Da Chen, Qingde Su |
| A method for near-infrared spectral calibration of complex plant samples with wavelet transform and elimination of uninformative variables | |
| Analytical and Bioanalytical Chemistry, 2004, 378(5):1382-1387 | |
| [4] | Xueguang Shao, Yadong Zhuang |
| Determination of chlorogenic acid in plant samples by using near-infrared spectrum with wavelet transform preprocessing | |
| Analytical Sciences, 2004, 20(3):451-454 | |
| [5] | Wang Fang, Chen Da, Shao Xueguang |
| Application of wavelet transform and partial least square in prediction of common chemical compositions in tobacco samples | |
| Tobacco Science and Technology (Chinese Journal), 2004, 3:31-34 | |
| [6] | Chaoxiong Ma, Xueguang Shao |
| Continuous wavelet transform applied to removing the fluctuating background in near-infrared spectra | |
| Journal of Chemical Information and Computer Sciences, 2004, 44(3):907-911 | |
| [7] | Yuhong Xiang, Haiyan Jiang, Wensheng Cai, Xueguang Shao |
| An efficient method based on lattice construction and the genetic algorithm for optimization of large Lennard-Jones clusters | |
| Journal of Physical Chemistry A, 2004, 108(16):3586-3592 | |
| [8] | Shao Nan, Cai Wensheng, Shao Xueguang, Pan Zhongxiao |
| Structural optimization and configurational transition of Cn(n=2-20) | |
| Computers and Applied Chemistry (Chinese Journal), 2004, 21(2):186-190 | |
| [9] | Longjiu Cheng, Wensheng Cai, Xueguang Shao |
| A connectivity table for cluster similarity checking in the evolutionary optimization method | |
| Chemical Physics Letters, 2004, 389(4-6):309-314 | |
| [10] | Wensheng Cai, Nan Shao, Xueguang Shao, Zhongxiao Pan |
| Structural analysis of carbon clusters by using a global optimization algorithm with Brenner potential | |
| Journal of Molecular Structure: THEOCHEM, 2004, 678(1-3):113-118 | |
| [11] | Da Chen, Bin Hu, Xueguang Shao, Qingde Su |
| Removal of major interference sources in aqueous near-infrared spectroscopy techniques | |
| Analytical and Bioanalytical Chemistry, 2004, 379(1):143-148 | |
| [12] | Da Chen, Xueguang Shao, Bin Hu, Qingde Su |
| A background and noise elimination method for quantitative calibration of near infrared spectra | |
| Analytica Chimica Acta, 2004, 511(1):37-45 | |
| [13] | Xueguang Shao, Guoqing Wang |
| Quantitative prediction of the normal boiling points for organic compounds by using the gas chromatographic retention times on two columns with different polarity | |
| Chromatographia, 2004, 59(9/10):615-620 | |
| [14] | Xueguang Shao, Longjiu Cheng, Wensheng Cai |
| An adaptive immune optimization algorithm for energy minimization problems | |
| Journal of Chemical Physics, 2004, 120(24):11401-11406 | |
| [15] | Xueguang Shao, Zhengliang Yu, Chaoxiong Ma |
| An improved transmutation method for quantitative determination of the component in multicomponent overlapping chromatograms | |
| Analytical and Bioanalytical Chemistry, 2004, 379(4):714-719 | |
| [16] | Chen Da, Wang Fang, Shao Xueguang, Su Qingde |
| Research on the nonlinear model of near infrared spectroscopy and the total sugar of tobacco samples | |
| Spectroscopy and Spectral Analysis (Chinese Journal), 2004, 24(6):672-674 | |
| [17] | Da Chen, Bin Hu, Xueguang Shao, Qingde Su |
| Variable selection by modified IPW (iterative predictor weighting)-PLS (partial least squares) in continuous wavelet regression models | |
| Analyst, 2004, 129(7):664-669 | |
| [18] | Xueguang Shao, Yuhong Xiang, Wensheng Cai |
| Formation of the central vacancy in icosahedral Lennard-Jones clusters | |
| Chemical Physics, 2004, 305(1-3):69-75 | |
| [19] | Xueguang Shao, Guoqing Wang, Sufang Wang, Qingde Su |
| Extraction of mass spectra and chromatographic profiles from overlapping GC-MS signal with background | |
| Analytical Chemistry, 2004, 76(17):5143-5148 | |
| [20] | Xueguang Shao, Longjiu Cheng, Wensheng Cai |
| A dynamic lattice searching method for fast optimization of Lennard-Jones clusters | |
| Journal of Computational Chemistry, 2004, 25(14):1693-1698 | |
| [21] | Yuhong Xiang, Longjiu Cheng, Wensheng Cai, Xueguang Shao |
| Structural distribution of Lennard-Jones clusters containing 562 to 1000 atoms | |
| Journal of Physical Chemistry A, 2004, 108(43):9516-9520 | |
| [22] | Wang Guo-Qing, Wang Fang, Chen Da, Su Qing-De, Shao Xue-Guang |
| A novel method for the determination of inorganic ions in complex plant samples by near infrared spectroscopy | |
| Spectroscopy and Spectral Analysis (Chinese Journal), 2004, 24(12):1540-1542 |