Shoichet BK - Search Results

1

Shoichet BK, McGovern SL, Wei B, Irwin JJ. Shoichet BK, et al. Curr Opin Chem Biol. 2002 Aug;6(4):439-46. doi: 10.1016/s1367-5931(02)00339-3. Curr Opin Chem Biol. 2002. PMID: 12133718 Review.

2

Protein docking and complementarity.

Shoichet BK, Kuntz ID. Shoichet BK, et al. J Mol Biol. 1991 Sep 5;221(1):327-46. doi: 10.1016/0022-2836(91)80222-g. J Mol Biol. 1991. PMID: 1920412

3

Predicting the structure of protein complexes: a step in the right direction.

Shoichet BK, Kuntz ID. Shoichet BK, et al. Chem Biol. 1996 Mar;3(3):151-6. doi: 10.1016/s1074-5521(96)90256-2. Chem Biol. 1996. PMID: 8807840 Review.

4

Flexible ligand docking using conformational ensembles.

Lorber DM, Shoichet BK. Lorber DM, et al. Among authors: shoichet bk. Protein Sci. 1998 Apr;7(4):938-50. doi: 10.1002/pro.5560070411. Protein Sci. 1998. PMID: 9568900 Free PMC article.

5

Structure-based discovery and in-parallel optimization of novel competitive inhibitors of thymidylate synthase.

Tondi D, Slomczynska U, Costi MP, Watterson DM, Ghelli S, Shoichet BK. Tondi D, et al. Among authors: shoichet bk. Chem Biol. 1999 May;6(5):319-31. doi: 10.1016/S1074-5521(99)80077-5. Chem Biol. 1999. PMID: 10322126

6

Ligand solvation in molecular docking.

Shoichet BK, Leach AR, Kuntz ID. Shoichet BK, et al. Proteins. 1999 Jan 1;34(1):4-16. doi: 10.1002/(sici)1097-0134(19990101)34:1<4::aid-prot2>3.0.co;2-6. Proteins. 1999. PMID: 10336382

7

Functional analyses of AmpC beta-lactamase through differential stability.

Beadle BM, McGovern SL, Patera A, Shoichet BK. Beadle BM, et al. Among authors: shoichet bk. Protein Sci. 1999 Sep;8(9):1816-24. doi: 10.1110/ps.8.9.1816. Protein Sci. 1999. PMID: 10493583 Free PMC article.

8

Structure-based design and in-parallel synthesis of inhibitors of AmpC beta-lactamase.

Tondi D, Powers RA, Caselli E, Negri MC, Blázquez J, Costi MP, Shoichet BK. Tondi D, et al. Among authors: shoichet bk. Chem Biol. 2001 Jun;8(6):593-611. doi: 10.1016/s1074-5521(01)00034-5. Chem Biol. 2001. PMID: 11410378

9

A common mechanism underlying promiscuous inhibitors from virtual and high-throughput screening.

McGovern SL, Caselli E, Grigorieff N, Shoichet BK. McGovern SL, et al. Among authors: shoichet bk. J Med Chem. 2002 Apr 11;45(8):1712-22. doi: 10.1021/jm010533y. J Med Chem. 2002. PMID: 11931626

10

Molecular docking and high-throughput screening for novel inhibitors of protein tyrosine phosphatase-1B.

Doman TN, McGovern SL, Witherbee BJ, Kasten TP, Kurumbail R, Stallings WC, Connolly DT, Shoichet BK. Doman TN, et al. Among authors: shoichet bk. J Med Chem. 2002 May 23;45(11):2213-21. doi: 10.1021/jm010548w. J Med Chem. 2002. PMID: 12014959

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