| 2009 |
|---|
| 12 | EE | Qishi Du,
Ri-Bo Huang,
Yu-Tuo Wei,
Zong-Wen Pang,
Li-Qin Du,
Kuo-Chen Chou:
Fragment-based quantitative structure-activity relationship (FB-QSAR) for fragment-based drug design.
Journal of Computational Chemistry 30(2): 295-304 (2009) |
| 2008 |
|---|
| 11 | EE | Qishi Du,
Ri-Bo Huang,
Yu-Tuo Wei,
Li-Qin Du,
Kuo-Chen Chou:
Multiple field three dimensional quantitative structure-activity relationship (MF-3D-QSAR).
Journal of Computational Chemistry 29(2): 211-219 (2008) |
| 2007 |
|---|
| 10 | EE | Qishi Du,
Ri-Bo Huang,
Yu-Tuo Wei,
Cheng-Hua Wang,
Kuo-Chen Chou:
Peptide reagent design based on physical and chemical properties of amino acid residues.
Journal of Computational Chemistry 28(12): 2043-2050 (2007) |
| 2006 |
|---|
| 9 | EE | Qishi Du,
Da-Peng Li,
Wen-Zhang He,
Kuo-Chen Chou:
Heuristic molecular lipophilicity potential (HMLP): Lipophilicity and hydrophilicity of amino acid side chains.
Journal of Computational Chemistry 27(6): 685-692 (2006) |
| 2005 |
|---|
| 8 | EE | Suzanne W. Sirois,
George Hatzakis,
Dongqing Wei,
Qishi Du,
Kuo-Chen Chou:
Assessment of chemical libraries for their druggability.
Computational Biology and Chemistry 29(1): 55-67 (2005) |
| 7 | EE | Qishi Du,
Peng-Jun Liu,
Paul G. Mezey:
Theoretical Derivation of Heuristic Molecular Lipophilicity Potential: A Quantum Chemical Description for Molecular Solvation.
Journal of Chemical Information and Modeling 45(2): 347-353 (2005) |
| 6 | EE | Qishi Du,
Paul G. Mezey,
Kuo-Chen Chou:
Heuristic molecular lipophilicity potential (HMLP): A 2D-QSAR study to LADH of molecular family pyrazole and derivatives.
Journal of Computational Chemistry 26(5): 461-470 (2005) |
| 2004 |
|---|
| 5 | EE | Suzanne W. Sirois,
Dongqing Wei,
Qishi Du,
Kuo-Chen Chou:
Virtual Screening for SARS-CoV Protease Based on KZ7088 Pharmacophore Points.
Journal of Chemical Information and Modeling 44(3): 1111-1122 (2004) |
| 1998 |
|---|
| 4 | EE | Qishi Du,
Paul G. Mezey:
Heuristic lipophilicity potential for computer-aided rational drug design: Optimizations of screening functions and parameters.
Journal of Computer-Aided Molecular Design 12(5): 451-470 (1998) |
| 1997 |
|---|
| 3 | EE | Qishi Du,
Gustavo A. Arteca,
Paul G. Mezey:
Heuristic lipophilicity potential for computer-aided rational drug design.
Journal of Computer-Aided Molecular Design 11(5): 503-515 (1997) |
| 1996 |
|---|
| 2 | EE | Qishi Du,
Gustavo A. Arteca:
Derivation of fused-sphere molecular surfaces from properties of the electrostatic potential distribution.
Journal of Computational Chemistry 17(10): 1258-1268 (1996) |
| 1 | | Qishi Du,
Gustavo A. Arteca:
Modeling lipophilicity from the distribution of electrostatic potential on a molecular surface.
Journal of Computer-Aided Molecular Design 10(2): 133-144 (1996) |
