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Results by year

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

Year Number of Results
1981 1
1989 1
1991 1
1992 1
1994 3
1995 1
1996 2
1998 2
1999 1
2000 2
2001 1
2002 2
2003 2
2004 6
2005 6
2006 3
2007 9
2008 5
2009 12
2010 13
2011 9
2012 1
2013 2
2014 2
2015 4
2016 5
2017 5
2018 3
2019 2
2020 11
2021 7
2022 5
2023 6

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130 results

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Page 1
Memorial Viewpoint for Nicholas A. Besley.
Hirst JD. Hirst JD. J Phys Chem A. 2021 Sep 30;125(38):8345-8346. doi: 10.1021/acs.jpca.1c07974. Epub 2021 Sep 17. J Phys Chem A. 2021. PMID: 34533958 No abstract available.
Kernel Methods for Predicting Yields of Chemical Reactions.
Haywood AL, Redshaw J, Hanson-Heine MWD, Taylor A, Brown A, Mason AM, Gärtner T, Hirst JD. Haywood AL, et al. Among authors: hirst jd. J Chem Inf Model. 2022 May 9;62(9):2077-2092. doi: 10.1021/acs.jcim.1c00699. Epub 2021 Oct 26. J Chem Inf Model. 2022. PMID: 34699222 Review.
Topical perspectives.
Hirst JD, Madura JD. Hirst JD, et al. J Mol Graph Model. 2010 Sep;29(2):115. doi: 10.1016/j.jmgm.2010.07.001. Epub 2010 Jul 22. J Mol Graph Model. 2010. PMID: 20655257 No abstract available.
Molecular Simulation of αvβ6 Integrin Inhibitors.
Guest EE, Oatley SA, Macdonald SJF, Hirst JD. Guest EE, et al. Among authors: hirst jd. J Chem Inf Model. 2020 Nov 23;60(11):5487-5498. doi: 10.1021/acs.jcim.0c00254. Epub 2020 Jun 2. J Chem Inf Model. 2020. PMID: 32421320
Vibrational Spectroscopic Map, Vibrational Spectroscopy, and Intermolecular Interaction.
Baiz CR, Błasiak B, Bredenbeck J, Cho M, Choi JH, Corcelli SA, Dijkstra AG, Feng CJ, Garrett-Roe S, Ge NH, Hanson-Heine MWD, Hirst JD, Jansen TLC, Kwac K, Kubarych KJ, Londergan CH, Maekawa H, Reppert M, Saito S, Roy S, Skinner JL, Stock G, Straub JE, Thielges MC, Tominaga K, Tokmakoff A, Torii H, Wang L, Webb LJ, Zanni MT. Baiz CR, et al. Among authors: hirst jd. Chem Rev. 2020 Aug 12;120(15):7152-7218. doi: 10.1021/acs.chemrev.9b00813. Epub 2020 Jun 29. Chem Rev. 2020. PMID: 32598850 Free PMC article. Review.
Active Search for Computer-aided Drug Design.
Oglic D, Oatley SA, Macdonald SJF, Mcinally T, Garnett R, Hirst JD, Gärtner T. Oglic D, et al. Among authors: hirst jd. Mol Inform. 2018 Jan;37(1-2). doi: 10.1002/minf.201700130. Epub 2018 Feb 1. Mol Inform. 2018. PMID: 29388736
Computed optical spectra of SARS-CoV-2 proteins.
Li Z, Hirst JD. Li Z, et al. Among authors: hirst jd. Chem Phys Lett. 2020 Nov;758:137935. doi: 10.1016/j.cplett.2020.137935. Epub 2020 Aug 29. Chem Phys Lett. 2020. PMID: 33518776 Free PMC article.
Search strategies in structural bioinformatics.
Oakley MT, Barthel D, Bykov Y, Garibaldi JM, Burke EK, Krasnogor N, Hirst JD. Oakley MT, et al. Among authors: hirst jd. Curr Protein Pept Sci. 2008 Jun;9(3):260-74. doi: 10.2174/138920308784534032. Curr Protein Pept Sci. 2008. PMID: 18537681 Review.
Machine learning in virtual screening.
Melville JL, Burke EK, Hirst JD. Melville JL, et al. Among authors: hirst jd. Comb Chem High Throughput Screen. 2009 May;12(4):332-43. doi: 10.2174/138620709788167980. Comb Chem High Throughput Screen. 2009. PMID: 19442063 Review.
Circular and linear dichroism of proteins.
Bulheller BM, Rodger A, Hirst JD. Bulheller BM, et al. Among authors: hirst jd. Phys Chem Chem Phys. 2007 May 7;9(17):2020-35. doi: 10.1039/b615870f. Epub 2007 Feb 20. Phys Chem Chem Phys. 2007. PMID: 17464384 Review.
130 results