| 2009 |
|---|
| 8 | EE | Shuyan Li,
Lili Xi,
Chengqi Wang,
Jiazhong Li,
Beilei Lei,
Huanxiang Liu,
Xiaojun Yao:
A novel method for protein-ligand binding affinity prediction and the related descriptors exploration.
Journal of Computational Chemistry 30(6): 900-909 (2009) |
| 2008 |
|---|
| 7 | EE | Jiazhong Li,
Beilei Lei,
Huanxiang Liu,
Shuyan Li,
Xiaojun Yao,
Mancang Liu,
Paola Gramatica:
QSAR study of malonyl-CoA decarboxylase inhibitors using GA-MLR and a new strategy of consensus modeling.
Journal of Computational Chemistry 29(16): 2636-2647 (2008) |
| 2006 |
|---|
| 6 | EE | Igor V. Tetko,
Vitaly P. Solov'ev,
Alexey V. Antonov,
Xiaojun Yao,
Jean-Pierre Doucet,
Bo Tao Fan,
Frank Hoonakker,
Denis Fourches,
Piere Jost,
Nicolas Lachiche,
Alexandre Varnek:
Benchmarking of Linear and Nonlinear Approaches for Quantitative Structure-Property Relationship Studies of Metal Complexation with Ionophores.
Journal of Chemical Information and Modeling 46(2): 808-819 (2006) |
| 2004 |
|---|
| 5 | EE | Xiaojun Yao,
Annick Panaye,
Jean-Pierre Doucet,
Ruisheng Zhang,
Haifeng Chen,
Mancang Liu,
Zhide Hu,
Bo Tao Fan:
Comparative Study of QSAR/QSPR Correlations Using Support Vector Machines, Radial Basis Function Neural Networks, and Multiple Linear Regression.
Journal of Chemical Information and Modeling 44(4): 1257-1266 (2004) |
| 4 | EE | C. X. Xue,
Ruisheng Zhang,
H. X. Liu,
Xiaojun Yao,
Mancang Liu,
Zhide Hu,
Bo Tao Fan:
QSAR Models for the Prediction of Binding Affinities to Human Serum Albumin Using the Heuristic Method and a Support Vector Machine.
Journal of Chemical Information and Modeling 44(5): 1693-1700 (2004) |
| 3 | EE | H. X. Liu,
C. X. Xue,
Ruisheng Zhang,
Xiaojun Yao,
Mancang Liu,
Zhide Hu,
Bo Tao Fan:
Quantitative Prediction of logk of Peptides in High-Performance Liquid Chromatography Based on Molecular Descriptors by Using the Heuristic Method and Support Vector Machine.
Journal of Chemical Information and Modeling 44(6): 1979-1986 (2004) |
| 2002 |
|---|
| 2 | EE | Xiaojun Yao,
Xiaoyun Zhang,
Ruisheng Zhang,
Mancang Liu,
Zhide Hu,
Bo Tao Fan:
Radial Basis Function Neural Network Based QSPR for the Prediction of Critical Pressures of Substituted Benzenes.
Computers & Chemistry 26(2): 159-169 (2002) |
| 2001 |
|---|
| 1 | EE | Xiaojun Yao,
Xiaoyun Zhang,
Ruisheng Zhang,
Mancang Liu,
Zhide Hu,
Bo Tao Fan:
Prediction of Enthalpy of Alkanes by the Use of Radial Basis Function Neural Networks.
Computers & Chemistry 25(5): 475-482 (2001) |
