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兰州大学机构库

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Theoretical Investigations of Tetrathiafulvalene Derivative as Electron Donor in Organic Dye for Dye-Sensitized Solar Cells 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2014, 卷号: 30, 期号: 2, 页码: 273-280
Authors:  Chen, XM;  Jia, CY;  Wan, ZQ;  Yao, XJ(姚小军);  Jia, CY (reprint author), Univ Elect Sci & Technol China, Sch Microelect & Solid State Elect, State Key Lab Elect Thin Films & Integrated Devic, Chengdu 610054, Peoples R China.
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Tetrathiafulvalene  Dye sensitizer  Density functional theory  Time-dependent density functional theory  Dye-sensitized solar cell  四硫富瓦烯  染料敏化剂  密度泛函理论  含时密度泛函理论  染料敏化太阳能电池  
Syntheses, Crystal Structures and Magnetic Properties of Cobalt(II) and Manganese(II) Coordination Polymers Constructed from 5-(Pyridin-4-yl)isophthalate Ligands 期刊论文
CHINESE JOURNAL OF STRUCTURAL CHEMISTRY, 2014, 卷号: 33, 期号: 4, 页码: 626-634
Authors:  Gao, ZQ;  Li, HJ;  Alexander, MK;  Gu, JZ(顾金忠);  Gao, ZQ (reprint author), Taiyuan Univ Sci & Technol, Sch Chem & Biol Engn, Taiyuan 030021, Peoples R China.
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coordination polymer  crystal structrue  magnetic properties  
A Novel Protocol for the Regioselective Bromination of Primary Alcohols in Unprotected Carbohydrates or Glycosides 期刊论文
CHINESE JOURNAL OF CHEMISTRY, 2012, 卷号: 30, 期号: 7, 页码: 1429-1432
Authors:  Xue, WH;  Zhang, LF;  Xue, WH (reprint author), Lanzhou Univ, Sch Pharm, Lanzhou 730000, Gansu, Peoples R China.
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regioselective  bromide  CPMA  free sugars  glycosides  
Quantitative Structure-retention Relationship Study on the GC-MS Retention Time of Illicit Drugs 期刊论文
CHINESE JOURNAL OF STRUCTURAL CHEMISTRY, 2010, 卷号: 29, 期号: 12
Authors:  Xia, BB;  Wang, YJ;  Yang, RQ;  Zhang, XY(张晓昀);  Yang, RQ (reprint author), Chinese Peoples PublicSecur Univ, Dept Forens Sci, Beijing 100038, Peoples R China.
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QSRR  GC-MS  heuristic method  illicit drugs  retention time  
烷基苯酚类化合物的气相色谱保留值与其结构参数的定量关系 期刊论文
色谱, 2007, 卷号: 25, 期号: 2, 页码: 248-253
Authors:  阮晓芳;  张瑞生;  姚小军;  刘满仓;  范波涛
Adobe PDF(154Kb)  |  Favorite  |    Submit date：2015/04/23
色谱保留值  结构参数  定量关系  烷基苯酚  支持向量机  启发式方法  
Prediction of the power rotation of the amino acid based on the quantitative structure-property relationship method 期刊论文
CHINESE JOURNAL OF ANALYTICAL CHEMISTRY, 2006, 卷号: 34, 期号: 12, 页码: 1759-1762
Authors:  Wang, J;  Liu, HX;  Si, HZ;  Yao, XJ(姚小军);  Liu, MC;  Hu, ZD(胡之德);  Hu, ZD (reprint author), Lanzhou Univ, Dept Chem, Lanzhou 730000, Peoples R China.
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amino acid  quantitative structure-property relationship  optical rotation  heuristic method  multi-linear regression  氨基酸  定量结构-性质关系  比旋光度  启发式算法  多元线性回归  
Prediction of binding rate of drug to human plasma protein based on heuristic method and support vector machine 期刊论文
ACTA CHIMICA SINICA, 2006, 卷号: 64, 期号: 5
Authors:  Si, HZ;  Yao, XJ(姚小军);  Liu, HX;  Wang, J;  Li, JZ;  Hu, ZD(胡之德);  Liu, MC;  Si, HZ (reprint author), Lanzhou Univ, Dept Chem, Lanzhou 730000, Peoples R China.
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quantitative structure-activity relationship  binding rate to human plasma protein  support vector machine  heuristic method  
Extensive studies on the AlEt3/THF-promoted diastereoselective tandem rearrangement/reduction of alpha-hydroxy (amino) heterocyclopropane: An efficient approach to 2-quaternary 1,3-diheteroatom units 期刊论文
CHINESE JOURNAL OF CHEMISTRY, 2004, 卷号: 22, 期号: 10
Authors:  Li, X;  Wang, BM;  Zhao, XZ;  Gao, SH;  Tu, YQ(涂永强);  Li, DR;  Tu, YQ (reprint author), Lanzhou Univ, Dept Chem, Lanzhou 730000, Gansu, Peoples R China.
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triethyl aluminium  tandem reaction  quaternary carbon  diastereoselectivity  amino alcohol  
3D-QSAR study on apicidin inhibit histone deacetylase 期刊论文
CHINESE JOURNAL OF CHEMISTRY, 2003, 卷号: 21, 期号: 12, 页码: 1596-1607
Authors:  Chen, HF;  Kang, JH;  Li, Q;  Zeng, BS;  Yao, XJ(姚小军);  Fan, BT;  Yuan, SG;  Panay, A;  Doucet, JP;  Chen, HF (reprint author), Chinese Acad Sci, Shanghai Inst Organ Chem, Key Lab Comp Chem, 345 Lingling Lu, Shanghai 200032, Peoples R China....Chen, HF;  Kang, JH;  Li, Q;  Zeng, BS;  Yao, XJ(姚小军);  Fan, BT;  Yuan, SG;  Panay, A;  Doucet, JP;  Chen, HF (reprint author), Chinese Acad Sci, Shanghai Inst Organ Chem, Key Lab Comp Chem, 345 Lingling Lu, Shanghai 200032, Peoples R China.
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histone deacetylase inhibitor  CoMFA  3D-QSAR  
Radial basis function neural networks based QSPR for the prediction of log P 期刊论文
CHINESE JOURNAL OF CHEMISTRY, 2002, 卷号: 20, 期号: 8
Authors:  Yao, XJ(姚小军);  Liu, MC;  Zhang, XY(张晓昀);  Zhang, RS(张瑞生);  Hu, ZD(胡之德);  Fan, BT;  Hu, ZD (reprint author), Lanzhou Univ, Dept Chem, Lanzhou 730000, Peoples R China.
Favorite  |    Submit date：2014/12/05
radial basis function neural network  QSPR  molecular descriptor  log P