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

Year Number of Results
1873 1
1906 1
1910 1
1913 1
1914 1
1915 1
1925 1
1967 1
1970 1
1972 1
1974 1
1976 1
1977 2
1980 2
1982 1
1984 1
1985 1
1987 2
1988 2
1990 3
1991 2
1992 7
1993 2
1994 3
1995 1
1996 6
1997 1
1998 4
1999 3
2000 8
2001 1
2002 1
2004 1
2005 1
2006 1
2007 1
2008 1
2009 2
2010 6
2011 3
2012 11
2013 11
2014 10
2015 10
2016 4
2017 4
2018 5
2019 10
2020 9
2021 20
2022 17
2023 20
2024 1

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196 results

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Page 1
Symmetric Molecular Dynamics.
Cox S, White AD. Cox S, et al. Among authors: white ad. J Chem Theory Comput. 2022 Jul 12;18(7):4077-4081. doi: 10.1021/acs.jctc.2c00401. Epub 2022 Jun 14. J Chem Theory Comput. 2022. PMID: 35699649 Free PMC article.
PTH/PTHrP Receptor Signaling, Allostery, and Structures.
Sutkeviciute I, Clark LJ, White AD, Gardella TJ, Vilardaga JP. Sutkeviciute I, et al. Among authors: white ad. Trends Endocrinol Metab. 2019 Nov;30(11):860-874. doi: 10.1016/j.tem.2019.07.011. Trends Endocrinol Metab. 2019. PMID: 31699241 Free PMC article. Review.
Bloom filters for molecules.
Medina J, White AD. Medina J, et al. Among authors: white ad. J Cheminform. 2023 Oct 12;15(1):95. doi: 10.1186/s13321-023-00765-1. J Cheminform. 2023. PMID: 37828615 Free PMC article.
The future of chemistry is language.
White AD. White AD. Nat Rev Chem. 2023 Jul;7(7):457-458. doi: 10.1038/s41570-023-00502-0. Nat Rev Chem. 2023. PMID: 37208543 No abstract available.
SELFIES and the future of molecular string representations.
Krenn M, Ai Q, Barthel S, Carson N, Frei A, Frey NC, Friederich P, Gaudin T, Gayle AA, Jablonka KM, Lameiro RF, Lemm D, Lo A, Moosavi SM, Nápoles-Duarte JM, Nigam A, Pollice R, Rajan K, Schatzschneider U, Schwaller P, Skreta M, Smit B, Strieth-Kalthoff F, Sun C, Tom G, Falk von Rudorff G, Wang A, White AD, Young A, Yu R, Aspuru-Guzik A. Krenn M, et al. Among authors: white ad. Patterns (N Y). 2022 Oct 14;3(10):100588. doi: 10.1016/j.patter.2022.100588. eCollection 2022 Oct 14. Patterns (N Y). 2022. PMID: 36277819 Free PMC article. Review.
A Perspective on Explanations of Molecular Prediction Models.
Wellawatte GP, Gandhi HA, Seshadri A, White AD. Wellawatte GP, et al. Among authors: white ad. J Chem Theory Comput. 2023 Apr 25;19(8):2149-2160. doi: 10.1021/acs.jctc.2c01235. Epub 2023 Mar 27. J Chem Theory Comput. 2023. PMID: 36972469 Free PMC article. Review.
Deep Learning for Molecules and Materials.
White AD. White AD. Living J Comput Mol Sci. 2022 Oct 26;3(1):1499. doi: 10.33011/livecoms.3.1.1499. Epub 2022 Jul 5. Living J Comput Mol Sci. 2022. PMID: 38111390 Free PMC article.
Ca2+ allostery in PTH-receptor signaling.
White AD, Fang F, Jean-Alphonse FG, Clark LJ, An HJ, Liu H, Zhao Y, Reynolds SL, Lee S, Xiao K, Sutkeviciute I, Vilardaga JP. White AD, et al. Proc Natl Acad Sci U S A. 2019 Feb 19;116(8):3294-3299. doi: 10.1073/pnas.1814670116. Epub 2019 Feb 4. Proc Natl Acad Sci U S A. 2019. PMID: 30718391 Free PMC article.
196 results