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Improving the quality of 3D-QSAR by using flexible-ligand receptor models 期刊论文
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2005, 卷号: 45, 期号: 6, 页码: 1920-1933
Authors:  Pei, JF;  Chen, H;  Liu, ZM;  Han, XF;  Wang, Q;  Shen, B;  Zhou, JJ;  Lai, LH
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Gamma-aminobutyric-acid  Binding Free-energy  Pseudoreceptor Models  Surface Models  Construction  Inhibitors  Alignment  4d-qsar  Qsar  Representation  
Pharmacophore models and 3D-QSAR studies of rat and fly's GABA receptor inhibitors 期刊论文
CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE, 2005, 卷号: 26, 期号: 3, 页码: 546-549
Authors:  Ren, TR;  Shen, B;  Pei, JF;  Wang, YS;  Xiang, WS
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Gaba(a) Receptor  Pharmacophore Model  3d-qsar  Comparative Molecular Field Analysis (Comfa)  
家蝇与大鼠GABA受体抑制剂的药效团模型及其3D-QSAR研究 期刊论文
高等学校化学学报, 2005, 卷号: 026, 期号: 003, 页码: 546
Authors:  任天瑞;  沈斌;  裴剑锋;  汪永生;  向文胜
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Estimating protein-ligand binding free energy: Atomic solvation parameters for partition coefficient and solvation free energy calculation 期刊论文
PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, 2004, 卷号: 57, 期号: 4, 页码: 651-664
Authors:  Pei, JF;  Wang, Q;  Zhou, JJ;  Lai, LH
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Asp  Log p  Solvent-accessible Surface Area  Asplogop  Protein-ligand Complex  Conformation-dependent  Score  
家蝇GABA受体抑制剂的比较分子相似性指数分析模型研究 期刊论文
计算机与应用化学, 2004, 期号: 02, 页码: 221-226
Authors:  沈斌;  张晔;  裴剑锋;  巨修练;  任天瑞
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Gaba受体  三维定量构效关系(3d-qsar)  比较分子相似性指数分析(Comsia)  
Comparative molecular field analysis of tyrosine kinase inhibitors 期刊论文
CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE, 2003, 卷号: 24, 期号: 6, 页码: 1076-1079
Authors:  Peng, T;  Pei, JF;  Zhou, JJ
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Tyrosine Kinase Inhibitor  Comparative Molecular Field Analysis (Comfa) 3d-qsar  
Pharmacophore analysis of epidermal growth factor receptor tyrosine kinase inhibitors 期刊论文
ACTA CHIMICA SINICA, 2003, 卷号: 61, 期号: 3, 页码: 430-434
Authors:  Peng, T;  Pei, JF;  Zhou, JJ
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Pharmacophore  Egfr  Tyrosine Kinase Inhibitor  Active Site  
化学标记语言及其应用 期刊论文
计算机与应用化学, 2003, 期号: Z1, 页码: 52-56
Authors:  彭涛;  裴剑锋;  周家驹
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化学信息  可扩展标记语言  化学标记语言  
3D-QSAR and receptor modeling of tyrosine kinase inhibitors with flexible atom receptor model (FLARM) 期刊论文
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES, 2003, 卷号: 43, 期号: 1, 页码: 298-303
Authors:  Peng, T;  Pei, JF;  Zhou, JJ
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Growth-factor Receptor  Binding-site Inhibitors  Irreversible  Inhibitors  Pharmacophore Model  Potent  Design  Analogs  4-(Phenylamino)Quinazoline  Strategies  Cancer  
Flexible atom receptor model study on tyrosine kinase inhibitors 期刊论文
ACTA CHIMICA SINICA, 2003, 卷号: 61, 期号: 1, 页码: 29-33
Authors:  Peng, T;  Pei, JF;  Zhou, JJ
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Tyrosine Kinase Inhibitor  3d-qsar  Flexible Atom Receptor Model