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

Year Number of Results
1986 1
1989 1
1995 1
1997 1
1998 1
1999 1
2001 3
2003 2
2004 4
2005 2
2006 3
2007 4
2008 2
2009 3
2010 4
2011 7
2012 13
2013 12
2014 10
2015 7
2016 10
2017 13
2018 8
2019 8
2020 6
2021 11
2022 9
2023 1
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Search Results

133 results
Results by year
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Page 1
Chemical graph generators.
Yirik MA, Steinbeck C. Yirik MA, et al. Among authors: steinbeck c. PLoS Comput Biol. 2021 Jan 5;17(1):e1008504. doi: 10.1371/journal.pcbi.1008504. eCollection 2021 Jan. PLoS Comput Biol. 2021. PMID: 33400699 Free PMC article.
DECIMER-hand-drawn molecule images dataset.
Brinkhaus HO, Zielesny A, Steinbeck C, Rajan K. Brinkhaus HO, et al. Among authors: steinbeck c. J Cheminform. 2022 Jun 9;14(1):36. doi: 10.1186/s13321-022-00620-9. J Cheminform. 2022. PMID: 35681226 Free PMC article.
Metabolomics: The Stethoscope for the Twenty-First Century.
Ashrafian H, Sounderajah V, Glen R, Ebbels T, Blaise BJ, Kalra D, Kultima K, Spjuth O, Tenori L, Salek RM, Kale N, Haug K, Schober D, Rocca-Serra P, O'Donovan C, Steinbeck C, Cano I, de Atauri P, Cascante M. Ashrafian H, et al. Among authors: steinbeck c. Med Princ Pract. 2021;30(4):301-310. doi: 10.1159/000513545. Epub 2020 Dec 3. Med Princ Pract. 2021. PMID: 33271569 Free PMC article. Review.
Current Challenges in Plant Eco-Metabolomics.
Peters K, Worrich A, Weinhold A, Alka O, Balcke G, Birkemeyer C, Bruelheide H, Calf OW, Dietz S, Dührkop K, Gaquerel E, Heinig U, Kücklich M, Macel M, Müller C, Poeschl Y, Pohnert G, Ristok C, Rodríguez VM, Ruttkies C, Schuman M, Schweiger R, Shahaf N, Steinbeck C, Tortosa M, Treutler H, Ueberschaar N, Velasco P, Weiß BM, Widdig A, Neumann S, Dam NMV. Peters K, et al. Among authors: steinbeck c. Int J Mol Sci. 2018 May 6;19(5):1385. doi: 10.3390/ijms19051385. Int J Mol Sci. 2018. PMID: 29734799 Free PMC article. Review.
RanDepict: Random chemical structure depiction generator.
Brinkhaus HO, Rajan K, Zielesny A, Steinbeck C. Brinkhaus HO, et al. Among authors: steinbeck c. J Cheminform. 2022 Jun 6;14(1):31. doi: 10.1186/s13321-022-00609-4. J Cheminform. 2022. PMID: 35668480 Free PMC article.
Global open data management in metabolomics.
Haug K, Salek RM, Steinbeck C. Haug K, et al. Among authors: steinbeck c. Curr Opin Chem Biol. 2017 Feb;36:58-63. doi: 10.1016/j.cbpa.2016.12.024. Epub 2017 Jan 13. Curr Opin Chem Biol. 2017. PMID: 28092796 Free PMC article. Review.
Surge: a fast open-source chemical graph generator.
McKay BD, Yirik MA, Steinbeck C. McKay BD, et al. Among authors: steinbeck c. J Cheminform. 2022 Apr 23;14(1):24. doi: 10.1186/s13321-022-00604-9. J Cheminform. 2022. PMID: 35461261 Free PMC article.
A review of optical chemical structure recognition tools.
Rajan K, Brinkhaus HO, Zielesny A, Steinbeck C. Rajan K, et al. Among authors: steinbeck c. J Cheminform. 2020 Oct 7;12(1):60. doi: 10.1186/s13321-020-00465-0. J Cheminform. 2020. PMID: 33372625 Free PMC article. Review.
KNIME-CDK: Workflow-driven cheminformatics.
Beisken S, Meinl T, Wiswedel B, de Figueiredo LF, Berthold M, Steinbeck C. Beisken S, et al. Among authors: steinbeck c. BMC Bioinformatics. 2013 Aug 22;14:257. doi: 10.1186/1471-2105-14-257. BMC Bioinformatics. 2013. PMID: 24103053 Free PMC article.
133 results