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

Year Number of Results
1984 2
1985 2
1991 2
1992 2
1993 1
1994 2
1995 5
1996 7
1997 1
1998 4
1999 5
2000 5
2001 6
2002 7
2003 6
2004 9
2005 6
2006 11
2007 3
2008 8
2009 7
2010 10
2011 11
2012 11
2013 12
2014 15
2015 14
2016 12
2017 10
2018 12
2019 8
2020 3
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Article attribute
Article type
Publication date

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203 results
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Page 1
Materials Informatics.
Senderowitz H, Tropsha A. Senderowitz H, et al. Among authors: Tropsha A. J Chem Inf Model. 2018 Jul 23;58(7):1313-1314. doi: 10.1021/acs.jcim.8b00016. Epub 2018 Apr 11. J Chem Inf Model. 2018. PMID: 29638126 No abstract available.
Materials Informatics.
Senderowitz H, Tropsha A. Senderowitz H, et al. Among authors: Tropsha A. J Chem Inf Model. 2018 Dec 24;58(12):2377-2379. doi: 10.1021/acs.jcim.8b00927. J Chem Inf Model. 2018. PMID: 30990041 No abstract available.
Chemistry, information and Frank: a tribute to Frank Brown.
Agrafiotis DK, Holloway MK, Johnson SA, Reynolds CH, Stouch TR, Tropsha A, Waller CL. Agrafiotis DK, et al. Among authors: Tropsha A. J Comput Aided Mol Des. 2018 Jul;32(7):723-729. doi: 10.1007/s10822-018-0135-9. Epub 2018 Jul 23. J Comput Aided Mol Des. 2018. PMID: 30039202 No abstract available.
A bibliometric review of drug repurposing.
Baker NC, Ekins S, Williams AJ, Tropsha A. Baker NC, et al. Among authors: Tropsha A. Drug Discov Today. 2018 Mar;23(3):661-672. doi: 10.1016/j.drudis.2018.01.018. Epub 2018 Jan 9. Drug Discov Today. 2018. PMID: 29330123 Free PMC article. Review.
QSAR modeling: where have you been? Where are you going to?
Cherkasov A, Muratov EN, Fourches D, Varnek A, Baskin II, Cronin M, Dearden J, Gramatica P, Martin YC, Todeschini R, Consonni V, Kuz'min VE, Cramer R, Benigni R, Yang C, Rathman J, Terfloth L, Gasteiger J, Richard A, Tropsha A. Cherkasov A, et al. Among authors: Tropsha A. J Med Chem. 2014 Jun 26;57(12):4977-5010. doi: 10.1021/jm4004285. Epub 2014 Jan 6. J Med Chem. 2014. PMID: 24351051 Free PMC article.
Deep reinforcement learning for de novo drug design.
Popova M, Isayev O, Tropsha A. Popova M, et al. Among authors: Tropsha A. Sci Adv. 2018 Jul 25;4(7):eaap7885. doi: 10.1126/sciadv.aap7885. eCollection 2018 Jul. Sci Adv. 2018. PMID: 30050984 Free PMC article.
Comprehensive characterization of the Published Kinase Inhibitor Set.
Elkins JM, Fedele V, Szklarz M, Abdul Azeez KR, Salah E, Mikolajczyk J, Romanov S, Sepetov N, Huang XP, Roth BL, Al Haj Zen A, Fourches D, Muratov E, Tropsha A, Morris J, Teicher BA, Kunkel M, Polley E, Lackey KE, Atkinson FL, Overington JP, Bamborough P, Müller S, Price DJ, Willson TM, Drewry DH, Knapp S, Zuercher WJ. Elkins JM, et al. Among authors: Tropsha A. Nat Biotechnol. 2016 Jan;34(1):95-103. doi: 10.1038/nbt.3374. Epub 2015 Oct 26. Nat Biotechnol. 2016. PMID: 26501955
CERAPP: Collaborative Estrogen Receptor Activity Prediction Project.
Mansouri K, Abdelaziz A, Rybacka A, Roncaglioni A, Tropsha A, Varnek A, Zakharov A, Worth A, Richard AM, Grulke CM, Trisciuzzi D, Fourches D, Horvath D, Benfenati E, Muratov E, Wedebye EB, Grisoni F, Mangiatordi GF, Incisivo GM, Hong H, Ng HW, Tetko IV, Balabin I, Kancherla J, Shen J, Burton J, Nicklaus M, Cassotti M, Nikolov NG, Nicolotti O, Andersson PL, Zang Q, Politi R, Beger RD, Todeschini R, Huang R, Farag S, Rosenberg SA, Slavov S, Hu X, Judson RS. Mansouri K, et al. Among authors: Tropsha A. Environ Health Perspect. 2016 Jul;124(7):1023-33. doi: 10.1289/ehp.1510267. Epub 2016 Feb 23. Environ Health Perspect. 2016. PMID: 26908244 Free PMC article.
Alarms about structural alerts.
Alves V, Muratov E, Capuzzi S, Politi R, Low Y, Braga R, Zakharov AV, Sedykh A, Mokshyna E, Farag S, Andrade C, Kuz'min V, Fourches D, Tropsha A. Alves V, et al. Among authors: Tropsha A. Green Chem. 2016 Aug 21;18(16):4348-4360. doi: 10.1039/C6GC01492E. Epub 2016 Jun 28. Green Chem. 2016. PMID: 28503093 Free PMC article.
Modernization of Enoxaparin Molecular Weight Determination Using Homogeneous Standards.
Arnold KM, Capuzzi SJ, Xu Y, Muratov EN, Carrick K, Szajek AY, Tropsha A, Liu J. Arnold KM, et al. Among authors: Tropsha A. Pharmaceuticals (Basel). 2017 Jul 22;10(3):66. doi: 10.3390/ph10030066. Pharmaceuticals (Basel). 2017. PMID: 28737679 Free PMC article.
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