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

Year Number of Results
1997 1
1998 1
2000 5
2001 3
2002 9
2003 7
2004 1
2006 3
2007 8
2008 1
2009 4
2010 4
2011 8
2012 2
2013 1
2014 1
2018 3
2019 4
2020 1
2021 1
2022 1
2024 0

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68 results

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Page 1
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. 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.
Epilogue to the Gerald Maggiora Festschrift: a tribute to an exemplary mentor, colleague, collaborator, and innovator.
Shanmugasundaram V, Bajorath J, Christoffersen RE, Petke JD, Howe WJ, Johnson MA, Agrafiotis DK, Lee P, Kuhn LA, Goodwin JT, Holloway MK, Doman TN, Walters WP, Schreyer S, Medina-Franco JL, Martinez-Mayorga K, Restifo LL. Shanmugasundaram V, et al. Among authors: agrafiotis dk. J Comput Aided Mol Des. 2022 Sep;36(9):623-638. doi: 10.1007/s10822-022-00473-2. Epub 2022 Sep 17. J Comput Aided Mol Des. 2022. PMID: 36114380
Combinatorial informatics in the post-genomics ERA.
Agrafiotis DK, Lobanov VS, Salemme FR. Agrafiotis DK, et al. Nat Rev Drug Discov. 2002 May;1(5):337-46. doi: 10.1038/nrd791. Nat Rev Drug Discov. 2002. PMID: 12120409 Review.
Recognizing pitfalls in virtual screening: a critical review.
Scior T, Bender A, Tresadern G, Medina-Franco JL, Martínez-Mayorga K, Langer T, Cuanalo-Contreras K, Agrafiotis DK. Scior T, et al. Among authors: agrafiotis dk. J Chem Inf Model. 2012 Apr 23;52(4):867-81. doi: 10.1021/ci200528d. Epub 2012 Apr 6. J Chem Inf Model. 2012. PMID: 22435959 Review.
Combinatorial networks.
Lobanov VS, Agrafiotis DK. Lobanov VS, et al. Among authors: agrafiotis dk. J Mol Graph Model. 2001;19(6):571-8, 610-3. doi: 10.1016/s1093-3263(01)00093-6. J Mol Graph Model. 2001. PMID: 11552686
Nonlinear mapping networks.
Agrafiotis DK, Lobanov VS. Agrafiotis DK, et al. J Chem Inf Comput Sci. 2000 Nov-Dec;40(6):1356-62. doi: 10.1021/ci000033y. J Chem Inf Comput Sci. 2000. PMID: 11128094
Stochastic proximity embedding.
Agrafiotis DK. Agrafiotis DK. J Comput Chem. 2003 Jul 30;24(10):1215-21. doi: 10.1002/jcc.10234. J Comput Chem. 2003. PMID: 12820129
A cross-source, system-agnostic solution for clinical data review.
Farnum MA, Ashok M, Kowalski D, Du F, Mohanty L, Konstant P, Ciervo J, Lobanov VS, Agrafiotis DK. Farnum MA, et al. Among authors: agrafiotis dk. Database (Oxford). 2019 Jan 1;2019:baz017. doi: 10.1093/database/baz017. Database (Oxford). 2019. PMID: 30773591 Free PMC article.
68 results