Biotech China 2014

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Peer Reviewed Papers, Books, Chapters

Year Title Citation Authors
1. 2010 Continued exploration of the triazolopyridine scaffold as a platform for p38 MAP kinase inhibition Bioorg. Med. Chem. Lett., 2010, 20, 469-473
2. 2009 Discovery of N-substituted pyridinones as potent and selective inhibitors of p38 kinase. Bioorg. Med. Chem. Lett., 2009, 19, 5851-5856.
3. 2009 Advancement of structure-activity relationship of multidrug resistance-associated protein 2 interactions. AAPS J, 2009, 11, 406-413
4. 2009 Homo-timeric structural model of human microsomal prostaglandin E synthase-1 and characterization of its substrate/inhibitor binding interactions J. Comput. Aided. Mol. Des., 2009, 23, 13-24
5. 2009 Sulfoximine-substituted trifluoromethylpyrimidine analogs as inhibitors of proline-rich tyrosine kinase 2 (PYK2) show reduced hERG activity. Bioorg. Med. Chem. Lett., 2009, 19, 3253-3258
6. 2009 2-(6-phenyl-1H-indazol-3-yl)-1H-benzo[d]imidazoles: Design and synthesis of a potent and isoform selective PKC-ζ inhibitor Bioorg. Med. Chem. Lett., 2009, 19, 908-911.
7. 2007 Structure-activity relationships for interaction with multidrug resistance protein 2 (ABCC2/MRP2): The role of torsion angles for a series of biphenyl-substituted heterocycles Drug Metab. Dispos., 2007, 35, 937-945
8. 2004 Evaluation and application of multiple scoring functions for a virtual screening experiment J. Comput. Aided. Mol. Des., 2004, 18, 333-344
9. 2004 Influence of molecular flexibility and polar surface area metrics on oral bioavailability in rat J. Med. Chem., 2004, 47, 6104-6107.
10. 2003 Predicting pKa by molecular tree structured fingerprints and PLS J. Chem. Inf. Comput. Sci., 2003, 43, 870-879
11. 2002 Novel methods for the prediction of logP, pKa, and logD J. Chem. Inf. Comput. Sci., 2002, 42, 796-805
12. 1999 Comparative molecular field analysis as a tool to evaluate mode of action of chemical hybridization agents J. Agric. Food Chem. 1999, 47, 245-5251
13. 1999 Comparison of estrogen receptor α and β subtypes based on comparative molecular field analysis (CoMFA). SAR QSAR Environ. Res. 1999, 10, 215-237
14. 1998 Large internal structures of micelles of triblock copolymers with small insoluble molecules in their cores. Langmuir 1998, 14, 4074-4080
15. 1997 Strong solubilization of small molecules by triblock-copolymer micelles in selective solvents Macromolecules 1997, 30, 1711-1717.
16. 1997 QSAR models for binding of estrogenic compounds to estrogen receptor  and  subtypes Endocrinology 1997, 138, 4022-4025
17. 1997 Geometric properties of micelles formed by triblock copolymers and solubilizates in dilute solutions. Macromol Theory Simul. 1997, 6, 553-563
18. 1996 Atomistic simulations of self-assembled monolayers that contain azobenzene Langmuir 1996, 12, 3024-3030
19. 1995 Designing packing of photo-responsive molecules to promote surface sensitivity Polym. Mater. Sci. Eng. 1995, 73, 400-401
20. 1995 Simulations of self-assembled monolayers with the same surface density, but different grafting patterns Langmuir 1995, 11, 2103-2108.


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