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Molecular mechanism of HIV-1 integrase-vDNA interactions and strand transfer inhibitor action: A molecular modeling perspective [期刊论文]
JOURNAL OF COMPUTATIONAL CHEMISTRY, 2012, 卷号: 33, 期号: 5
Xue, WW; Liu, HX; Yao, XJ(姚小军)
  |  View/Download:40/0
 
A Sequence-Based Computational Model for the Prediction of the Solvent Accessible Surface Area for alpha-Helix and beta-Barrel Transmembrane Residues [期刊论文]
JOURNAL OF COMPUTATIONAL CHEMISTRY, 2012, 卷号: 33, 期号: 1
Wang, CQ; Xi, LL; Li, SY; Liu, HX; Yao, XJ(姚小军)
  |  View/Download:64/1
 
Molecular Modeling Study of Checkpoint Kinase 1 Inhibitors by Multiple Docking Strategies and Prime/MM-GBSA Calculation [期刊论文]
JOURNAL OF COMPUTATIONAL CHEMISTRY, 2011, 卷号: 32, 期号: 13
Du, J; Sun, HJ; Xi, LL; Li, JZ; Yang, Y(杨瑛); Liu, HX; Yao, XJ(姚小军)
  |  View/Download:135/1
 
In silico Prediction of Deleterious Single Amino Acid Polymorphisms from Amino Acid Sequence [期刊论文]
JOURNAL OF COMPUTATIONAL CHEMISTRY, 2011, 卷号: 32, 期号: 7
Li, SY; Xi, LL; Li, JZ; Wang, CQ; Lei, BL; Shen, YL; Liu, HX; Yao, XJ(姚小军); Li, BA
  |  View/Download:45/0
 
Structure-Based Quantitative Structure-Activity Relationship Studies of Checkpoint Kinase 1 Inhibitors [期刊论文]
JOURNAL OF COMPUTATIONAL CHEMISTRY, 2010, 卷号: 31, 期号: 15
Du, JA; Xi, LL; Lei, BL; Lu, J; Li, JZ; Liu, HX; Yao, XJ(姚小军)
  |  View/Download:29/0
 
A New Strategy to Improve the Predictive Ability of the Local Lazy Regression and Its Application to the QSAR Study of Melanin-Concentrating Hormone Receptor 1 Antagonists [期刊论文]
JOURNAL OF COMPUTATIONAL CHEMISTRY, 2010, 卷号: 31, 期号: 5
Li, JZ; Li, SY; Lei, BL; Liu, HX; Yao, XJ(姚小军); Liu, MC; Gramatica, P
  |  View/Download:34/0
 
A Combined Molecular Modeling Study on Gelatinases and Their Potent Inhibitors [期刊论文]
JOURNAL OF COMPUTATIONAL CHEMISTRY, 2010, 卷号: 31, 期号: 1
Xi, LL; Du, J; Li, SY; Li, JZ; Liu, HX; Yao, XJ(姚小军)
  |  View/Download:59/0
 
A Novel Method for Protein-Ligand Binding Affinity Prediction and the Related Descriptors Exploration [期刊论文]
JOURNAL OF COMPUTATIONAL CHEMISTRY, 2009, 卷号: 30, 期号: 6
Li, SY; Xi, LL; Wang, CQ; Li, JZ; Lei, BL; Liu, HX; Yao, XJ(姚小军)
  |  View/Download:31/0
 
QSAR Study of Malonyl-CoA Decarboxylase Inhibitors Using GA-MLR and a New Strategy of Consensus Modeling [期刊论文]
JOURNAL OF COMPUTATIONAL CHEMISTRY, 2008, 卷号: 29, 期号: 16
Li, JZ; Lei, RL; Liu, HX; Li, SY; Yao, XJ(姚小军); Liu, MC; Gramatica, P
  |  View/Download:34/0
 

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