Dr. Zengjian
Hu
Howard University,
USA
Research
Associate
Email: zhu@howard.edu
Qualifications
1998
Ph.D., Shanghai Institute of Meteria Madica, Chinese Academy of Sciences,
Organic Chemistry
1987
M.Sc., East China Normal University, Quantum Chemistry
Publications(Selected)
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Hu Z, Chen D,
Dong L, Southerland WM. Prediction of the interaction of HIV-1 integrase and
its dicaffeoylquinic acid inhibitor through molecular modeling approach. J
Ethnicity and Disease. 2010; 20(1 Suppl 1): S1-45-9.
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Hu Z, Bai L,
Chen D, Dong L, Wang X, Southerland W. Computational Approaches to Understand
the Interaction of HIV-1 Integrase and Baicalein. BIOCOMP. 2009.
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Hu Z, Bai L,
Tizabi Y, Southerland W. Computational modeling study of human nicotinic
acetylcholine receptor for developing new drugs in the treatment of alcoholism.
Interdiscip Sci. 2009; 1: 254-262.
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Bai L, Xu Q,
Lingani G, Gloster CS, Southerland W, Hu Z. Computer-Assistant Drug Discovery
with the Netezza Architecture. ICBBE. 2008: 1319-1322.
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Hu Z, Bowen D,
Southerland WM, del Sol A, Pan Y, Nussinov R, Ma B. Ligand Binding and Circular
Permutation Modify Residue Interaction Network in DHFR. PLoS Computational
Biology, 2007; 3: 1097-1107.
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Hu Z,
Southerland W, WinDock: Structure-based drug discovery on Windows-based PCs.
Journal of Computational Chemistry, 2007; 28: 2347-2351.
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Lingani G, Hu
Z, Burge L, Southerland W. Enhancing Biomedical Knowledge through Computational
Methods: Howard University Center for Computational Biology and Bioinformatics.
BIOCOMP. 2007: 745-747.
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Hu Z, Drug
Discovery in the Post-Genomic Era: Systems-Based Drug Discovery. ICBBE. 2007:
406 - 408.
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Xu Q, Bai
L, Hu Z. NCL-3D: A 3D Natural Compound Library for Structure-Based Drug
Discovery. ICBBE. 2007: 367 - 369.
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Hu Z, Ma Y,
Southerland W. Computer Modeling Study of Small Molecule Inhibitors of
Ubiquitin-activating Enzyme (El). ICBBE. 2007: 84 - 85.
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Gill J, Burge
L, Hu Z, Southerland WM. WebDock: A Structure-Based Drug Discovery Web Service.
BIOCOMP. 2006: 547-548.
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Nikolovska-Coleska
Z, Xu L, Hu Z, Tomita Y, Li P, Roller PP, Wang R, Fang X, Guo R, Zhang M,
Lippman ME, Yang D, Wang S. Discovery of embelin as a cell-permeable,
small-molecular weight inhibitor of XIAP through structure-based computational
screening of a traditional herbal medicine three-dimensional structure
database. J Med Chem. 2004; 47: 2430-2440.
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Varady J, Wu
X, Fang X, Min J, Hu Z, Levant B, Wang S. Molecular Modeling of the
Three-Dimensional Structure of Dopamine 3 (D3) Subtype Receptor. Discovery of
Novel and Potent D3 Ligands Through A Hybrid Pharmacophore- and Structure-Based
Database Searching Approach. J Med Chem. 2003; 46: 4377-4392.
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Shao L, Lewin
NE, Lorenzo PS, Hu Z, Enyedy IJ, Garfield SH, Stone JC, Marner F-J, Blumberg
PM, Wang S. Iridals Are a Novel Class of Ligands for Phorbol Ester Receptors
with Modest Selectivity for the RasGRP Receptor Subfamily. Journal of Medicinal
Chemistry, 2001; 44: 3872-3880.
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Hu Z, Ma B,
Wolfson H, Nussinov R. Conservation of Polar Residues as Hot Spots at Protein
Interfaces, Proteins: Structure, Function, and Genetics, 2000; 39: 331-342.
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16.16. Ma B,
Kumar S, Tsai C-J, Hu Z, Nussinov R. Transition-state Ensemble in Enzyme
Catalysis: Possibility, reality, or Necessity? J. Theor. Biol., 2000; 203:
383-397.
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Yang Y, Ji R,
Hu Z, Chen K, Wu J. Synthesis and Structure-Activity Relationships of
Levofloxacin Analogs, Journal of Pharmacy, 1999; 34: 197-202.
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Hu Z, Jiang H,
Chen J, Chen K, Ji R. Electronic Structures of Physostigmine Analogues, Acta
Pharmacologica Sinica, 1998; 19: 322-326.
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Jiang H, Hu Z,
Chen J, Gu J, Zhu W, Chen K, Ji R. Computer Modeling for Interaction of Ligands
and Receptors and Their Applications in Drug Design, Progress in Chemistry,
1998; 10:427-441.
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Yang Y, Ji R,
Hu Z, Chen K. New Practical Route to Stereospecific Synthesis of
(S)-(-)-ofloxacin, Journal of Pharmacy, 1998; 33:828-831.
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Jiang H, Chen
K, Chen J, Gu J, Zhu W, Hu Z, Ji R. A Searching Method of the Molecular Active
Conformation in Solution, Chinese Science Bulletin, 1998; 43:110-111.
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Chen J, Chen
K, Jiang H, Gu J, Zhu W, Hu Z, Ji R. Enzyme 3D Structure-based Study of
Acetylcholinesterase Inhibitor – Huperzine A and Analogs, Progress in Natural
Science, 1998; 8:683-691.
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Chen J, Chen
K, Jiang H, Gu J, Zhu W, Hu Z, Ji R. Quantum Chemical Investigation on
Solvation of Ginkgolides, Science in China B-Chemistry, 1998; 41: 494-503.
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Chen J, Chen
K, Jiang H, Gu J, Zhu W, Hu Z, Ji R. Quantum Chemical Study of Ginkgol Lactone
and Analogs in Solution, Science in China B-Chemistry, 1998; 28: 316-325.
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Yang Y, Hu Z,
Ji R, Chen K. Catalytic Antibodies and their Applications, Chinese Chemistry
Bulletin, 1997; (10): 1-9.
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Jiang H, Chen
K, Chen J, Gu J, Hu Z, Liu D, Wang Q, Wang W, Zhao S, Rong S, Yang Y, Zhu W, Ji
R. Searching Method of Ligand Active Conformation and its Application: I.
Searching Method and the Search of the Active Conformation of Thrombin
Inhibitors, Science in China, 1997; 27:411-418.
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Jiang H, Chen
K, Chen J, Gu J, Hu Z, Liu D, Zhu W, Ji R. A Searching Method of Ligand Active
Conformation Based on the 3 Dimensional Structure of the Receptor, Chinese
Science Bulletin, 1997; 42: 887-888.
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Zhao S, Chen K,
Wang W, Gu J, Hu Z, Ji R. Molecular modeling of voltage-gated potassium channel
pore, Acta Pharmacologica Sinica, 1997; 18: 323-330.
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Hu Z, Jiang H,
Chen K, and Ji R. New Progresses in Studies on Antiviral Drugs, Chinese
Pharmacological Bulletin, 1996; 12: 385-388.
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Hu Z, Bai L,
Bai P, Fu R. Present and Prospect of Calculation Methods of quantum
Pharmacology, Henan Medical Research, 1993; 2: 45-50.
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Hu Z, Zhang X,
Luo H. The Design and Exploiting of the Microcomputer Program of Quantum
chemical DV-XA Method, Journal of Guizhou Normal University, 1988; 1: 17-30.