Caflisch A - Search Results

1

Discovery of Inhibitors of Four Bromodomains by Fragment-Anchored Ligand Docking.

Marchand JR, Dalle Vedove A, Lolli G, Caflisch A. Marchand JR, et al. Among authors: caflisch a. J Chem Inf Model. 2017 Oct 23;57(10):2584-2597. doi: 10.1021/acs.jcim.7b00336. Epub 2017 Sep 18. J Chem Inf Model. 2017. PMID: 28862840

2

Efficient electrostatic solvation model for protein-fragment docking.

Majeux N, Scarsi M, Caflisch A. Majeux N, et al. Among authors: caflisch a. Proteins. 2001 Feb 1;42(2):256-68. doi: 10.1002/1097-0134(20010201)42:2<256::aid-prot130>3.0.co;2-4. Proteins. 2001. PMID: 11119650

3

Fragment-Based flexible ligand docking by evolutionary optimization.

Budin N, Majeux N, Caflisch A. Budin N, et al. Among authors: caflisch a. Biol Chem. 2001 Sep;382(9):1365-72. doi: 10.1515/BC.2001.168. Biol Chem. 2001. PMID: 11688719

4

In silico discovery of beta-secretase inhibitors.

Huang D, Lüthi U, Kolb P, Cecchini M, Barberis A, Caflisch A. Huang D, et al. Among authors: caflisch a. J Am Chem Soc. 2006 Apr 26;128(16):5436-43. doi: 10.1021/ja0573108. J Am Chem Soc. 2006. PMID: 16620115

5

Discovery of kinase inhibitors by high-throughput docking and scoring based on a transferable linear interaction energy model.

Kolb P, Huang D, Dey F, Caflisch A. Kolb P, et al. Among authors: caflisch a. J Med Chem. 2008 Mar 13;51(5):1179-88. doi: 10.1021/jm070654j. Epub 2008 Feb 14. J Med Chem. 2008. PMID: 18271520

6

Fragment-based de novo ligand design by multiobjective evolutionary optimization.

Dey F, Caflisch A. Dey F, et al. Among authors: caflisch a. J Chem Inf Model. 2008 Mar;48(3):679-90. doi: 10.1021/ci700424b. Epub 2008 Feb 29. J Chem Inf Model. 2008. PMID: 18307332

7

Structure-based tailoring of compound libraries for high-throughput screening: discovery of novel EphB4 kinase inhibitors.

Kolb P, Kipouros CB, Huang D, Caflisch A. Kolb P, et al. Among authors: caflisch a. Proteins. 2008 Oct;73(1):11-8. doi: 10.1002/prot.22028. Proteins. 2008. PMID: 18384152

8

Data management system for distributed virtual screening.

Zhou T, Caflisch A. Zhou T, et al. Among authors: caflisch a. J Chem Inf Model. 2009 Jan;49(1):145-52. doi: 10.1021/ci800295q. J Chem Inf Model. 2009. PMID: 19072299

9

Discovery of plasmepsin inhibitors by fragment-based docking and consensus scoring.

Friedman R, Caflisch A. Friedman R, et al. Among authors: caflisch a. ChemMedChem. 2009 Aug;4(8):1317-26. doi: 10.1002/cmdc.200900078. ChemMedChem. 2009. PMID: 19472268 Free article.

10

Library screening by fragment-based docking.

Huang D, Caflisch A. Huang D, et al. Among authors: caflisch a. J Mol Recognit. 2010 Mar-Apr;23(2):183-93. doi: 10.1002/jmr.981. J Mol Recognit. 2010. PMID: 19718684 Free article. Review.

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