Qishi Du

Publication Activity (10 Years)

Years Active: 1996-2012
Publications (10 Years): 0

Top Topics

Sequence Analysis

Protein Protein Interactions

Modeling Method

Building Blocks

Top Venues

J. Comput. Chem.

J. Chem. Inf. Model.

Publications

Cheng-Hua Wang, Ri-Bo Huang, Bingfang He, Qishi Du
Improving the thermostability of alpha-amylase by combinatorial coevolving-site saturation mutagenesis. BMC Bioinform. 13 (2012)
Qishi Du, Jing Gao, Yu-Tuo Wei, Li-Qin Du, Shu-Qing Wang, Ri-Bo Huang
Structure-Based and Multiple Potential Three-Dimensional Quantitative Structure-Activity Relationship (SB-MP-3D-QSAR) for Inhibitor Design. J. Chem. Inf. Model. 52 (4) (2012)
Qishi Du, Si-Yu Long, Jian-Zong Meng, Ri-Bo Huang
Empirical formulation and parameterization of cation-π interactions for protein modeling. J. Comput. Chem. 33 (2) (2012)
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. J. Comput. Chem. 30 (2) (2009)
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). J. Comput. Chem. 29 (2) (2008)
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. J. Comput. Chem. 28 (12) (2007)
Qishi Du, Dapeng Li, Wen-Zhang He, Kuo-Chen Chou
Heuristic molecular lipophilicity potential (HMLP): Lipophilicity and hydrophilicity of amino acid side chains. J. Comput. Chem. 27 (6) (2006)
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. J. Comput. Chem. 26 (5) (2005)
Suzanne W. Sirois, George E. Hatzakis, Dongqing Wei, Qishi Du, Kuo-Chen Chou
Assessment of chemical libraries for their druggability. Comput. Biol. Chem. 29 (1) (2005)
Qishi Du, Peng-Jun Liu, Paul G. Mezey
Theoretical Derivation of Heuristic Molecular Lipophilicity Potential: A Quantum Chemical Description for Molecular Solvation. J. Chem. Inf. Model. 45 (2) (2005)
Suzanne W. Sirois, Dongqing Wei, Qishi Du, Kuo-Chen Chou
Virtual Screening for SARS-CoV Protease Based on KZ7088 Pharmacophore Points. J. Chem. Inf. Model. 44 (3) (2004)
Qishi Du, Paul G. Mezey
Heuristic lipophilicity potential for computer-aided rational drug design: Optimizations of screening functions and parameters. J. Comput. Aided Mol. Des. 12 (5) (1998)
Qishi Du, Gustavo A. Arteca, Paul G. Mezey
Heuristic lipophilicity potential for computer-aided rational drug design. J. Comput. Aided Mol. Des. 11 (5) (1997)
Qishi Du, Gustavo A. Arteca
Derivation of fused-sphere molecular surfaces from properties of the electrostatic potential distribution. J. Comput. Chem. 17 (10) (1996)
Qishi Du, Gustavo A. Arteca
Modeling lipophilicity from the distribution of electrostatic potential on a molecular surface. J. Comput. Aided Mol. Des. 10 (2) (1996)