Tropsha A - Search Results

1

Discovery of geranylgeranyltransferase-I inhibitors with novel scaffolds by the means of quantitative structure-activity relationship modeling, virtual screening, and experimental validation.

Peterson YK, Wang XS, Casey PJ, Tropsha A. Peterson YK, et al. Among authors: tropsha a. J Med Chem. 2009 Jul 23;52(14):4210-20. doi: 10.1021/jm8013772. J Med Chem. 2009. PMID: 19537691 Free PMC article.

2

Cross-validated R2-guided region selection for comparative molecular field analysis: a simple method to achieve consistent results.

Cho SJ, Tropsha A. Cho SJ, et al. Among authors: tropsha a. J Med Chem. 1995 Mar 31;38(7):1060-6. doi: 10.1021/jm00007a003. J Med Chem. 1995. PMID: 7707309

3

Antitumor agents. 152. In vitro inhibitory activity of etoposide derivative NPF against human tumor cell lines and a study of its conformation by X-ray crystallography, molecular modeling, and NMR spectroscopy.

Zhang YL, Tropsha A, McPhail AT, Lee KH. Zhang YL, et al. Among authors: tropsha a. J Med Chem. 1994 May 13;37(10):1460-4. doi: 10.1021/jm00036a011. J Med Chem. 1994. PMID: 8182704

4

Conformational analysis of D1 dopamine receptor agonists: pharmacophore assessment and receptor mapping.

Mottola DM, Laiter S, Watts VJ, Tropsha A, Wyrick SD, Nichols DE, Mailman RB. Mottola DM, et al. Among authors: tropsha a. J Med Chem. 1996 Jan 5;39(1):285-96. doi: 10.1021/jm9502100. J Med Chem. 1996. PMID: 8568818

5

Antitumor agents. 163. Three-dimensional quantitative structure-activity relationship study of 4'-O-demethylepipodophyllotoxin analogs using the modified CoMFA/q2-GRS approach.

Cho SJ, Tropsha A, Suffness M, Cheng YC, Lee KH. Cho SJ, et al. Among authors: tropsha a. J Med Chem. 1996 Mar 29;39(7):1383-95. doi: 10.1021/jm9503052. J Med Chem. 1996. PMID: 8691468

6

Structure-based alignment and comparative molecular field analysis of acetylcholinesterase inhibitors.

Cho SJ, Garsia ML, Bier J, Tropsha A. Cho SJ, et al. Among authors: tropsha a. J Med Chem. 1996 Dec 20;39(26):5064-71. doi: 10.1021/jm950771r. J Med Chem. 1996. PMID: 8978837

The application of cross-validated R2 guided region selection method, recently developed in this laboratory (Cho, S.J.; Tropsha, A. Cross-Validated R2 Guided Region Selection for Comparative Molecular Field Analysis (CoMFA): A Simple Method to Achieve Consist …

The application of cross-validated R2 guided region selection method, recently developed in this laboratory (Cho, S.J.; Tropsha, A …

7

Synthesis, evaluation, and comparative molecular field analysis of 1-phenyl-3-amino-1,2,3,4-tetrahydronaphthalenes as ligands for histamine H(1) receptors.

Bucholtz EC, Brown RL, Tropsha A, Booth RG, Wyrick SD. Bucholtz EC, et al. Among authors: tropsha a. J Med Chem. 1999 Aug 12;42(16):3041-54. doi: 10.1021/jm980428x. J Med Chem. 1999. PMID: 10447948

8

Quantitative structure-activity relationship modeling of dopamine D(1) antagonists using comparative molecular field analysis, genetic algorithms-partial least-squares, and K nearest neighbor methods.

Hoffman B, Cho SJ, Zheng W, Wyrick S, Nichols DE, Mailman RB, Tropsha A. Hoffman B, et al. Among authors: tropsha a. J Med Chem. 1999 Aug 26;42(17):3217-26. doi: 10.1021/jm980415j. J Med Chem. 1999. PMID: 10464009

9

Antitumor agents. 199. Three-dimensional quantitative structure-activity relationship study of the colchicine binding site ligands using comparative molecular field analysis.

Zhang SX, Feng J, Kuo SC, Brossi A, Hamel E, Tropsha A, Lee KH. Zhang SX, et al. Among authors: tropsha a. J Med Chem. 2000 Jan 27;43(2):167-76. doi: 10.1021/jm990333a. J Med Chem. 2000. PMID: 10649972

10

Antitumor agents. 213. Modeling of epipodophyllotoxin derivatives using variable selection k nearest neighbor QSAR method.

Xiao Z, Xiao YD, Feng J, Golbraikh A, Tropsha A, Lee KH. Xiao Z, et al. Among authors: tropsha a. J Med Chem. 2002 May 23;45(11):2294-309. doi: 10.1021/jm0105427. J Med Chem. 2002. PMID: 12014968

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