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Table representation of search results timeline featuring number of search results per year.

Year Number of Results
2002 1
2003 3
2004 1
2005 1
2006 1
2007 2
2008 1
2009 2
2010 3
2011 5
2012 5
2013 4
2014 6
2015 8
2016 8
2017 7
2018 11
2019 10
2020 7
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Search Results

75 results
Results by year
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Page 1
Evolution of commercially available compounds for HTS.
Volochnyuk DM, Ryabukhin SV, Moroz YS, Savych O, Chuprina A, Horvath D, Zabolotna Y, Varnek A, Judd DB. Volochnyuk DM, et al. Among authors: horvath d. Drug Discov Today. 2019 Feb;24(2):390-402. doi: 10.1016/j.drudis.2018.10.016. Epub 2018 Nov 3. Drug Discov Today. 2019. PMID: 30399443 Free article. Review.
Diversifying chemical libraries with generative topographic mapping.
Lin A, Beck B, Horvath D, Marcou G, Varnek A. Lin A, et al. Among authors: horvath d. J Comput Aided Mol Des. 2020 Jul;34(7):805-815. doi: 10.1007/s10822-019-00215-x. Epub 2019 Aug 12. J Comput Aided Mol Des. 2020. PMID: 31407224
Multi-task generative topographic mapping in virtual screening.
Lin A, Horvath D, Marcou G, Beck B, Varnek A. Lin A, et al. Among authors: horvath d. J Comput Aided Mol Des. 2019 Mar;33(3):331-343. doi: 10.1007/s10822-019-00188-x. Epub 2019 Feb 9. J Comput Aided Mol Des. 2019. PMID: 30739238
Generative Topographic Mapping of Conformational Space.
Horvath D, Baskin I, Marcou G, Varnek A. Horvath D, et al. Mol Inform. 2017 Oct;36(10). doi: 10.1002/minf.201700036. Epub 2017 Apr 19. Mol Inform. 2017. PMID: 28421706
Pharmacophore-based virtual screening.
Horvath D. Horvath D. Methods Mol Biol. 2011;672:261-98. doi: 10.1007/978-1-60761-839-3_11. Methods Mol Biol. 2011. PMID: 20838973 Review.
Generative Topographic Mapping of the Docking Conformational Space.
Horvath D, Marcou G, Varnek A. Horvath D, et al. Molecules. 2019 Jun 18;24(12):2269. doi: 10.3390/molecules24122269. Molecules. 2019. PMID: 31216756 Free PMC article.
Virtual Screening with Generative Topographic Maps: How Many Maps Are Required?
Casciuc I, Zabolotna Y, Horvath D, Marcou G, Bajorath J, Varnek A. Casciuc I, et al. Among authors: horvath d. J Chem Inf Model. 2019 Jan 28;59(1):564-572. doi: 10.1021/acs.jcim.8b00650. Epub 2018 Dec 31. J Chem Inf Model. 2019. PMID: 30567430
Rescoring of docking poses under Occam's Razor: are there simpler solutions?
Zhenin M, Bahia MS, Marcou G, Varnek A, Senderowitz H, Horvath D. Zhenin M, et al. Among authors: horvath d. J Comput Aided Mol Des. 2018 Sep;32(9):877-888. doi: 10.1007/s10822-018-0155-5. Epub 2018 Sep 1. J Comput Aided Mol Des. 2018. PMID: 30173397
Transductive Ridge Regression in Structure-activity Modeling.
Marcou G, Delouis G, Mokshyna O, Horvath D, Lachiche N, Varnek A. Marcou G, et al. Among authors: horvath d. Mol Inform. 2018 Jan;37(1-2). doi: 10.1002/minf.201700112. Epub 2017 Nov 2. Mol Inform. 2018. PMID: 29095574
Integrated Strategy for Lead Optimization Based on Fragment Growing: The Diversity-Oriented-Target-Focused-Synthesis Approach.
Hoffer L, Voitovich YV, Raux B, Carrasco K, Muller C, Fedorov AY, Derviaux C, Amouric A, Betzi S, Horvath D, Varnek A, Collette Y, Combes S, Roche P, Morelli X. Hoffer L, et al. Among authors: horvath d. J Med Chem. 2018 Jul 12;61(13):5719-5732. doi: 10.1021/acs.jmedchem.8b00653. Epub 2018 Jun 22. J Med Chem. 2018. PMID: 29883107
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