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

Year Number of Results
2004 1
2005 3
2007 1
2008 5
2009 8
2010 5
2011 16
2012 21
2013 12
2014 26
2015 16
2016 14
2017 16
2018 26
2019 11
2020 20
2021 4
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197 results
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Page 1
Deep learning enables rapid identification of potent DDR1 kinase inhibitors.
Zhavoronkov A, Ivanenkov YA, Aliper A, Veselov MS, Aladinskiy VA, Aladinskaya AV, Terentiev VA, Polykovskiy DA, Kuznetsov MD, Asadulaev A, Volkov Y, Zholus A, Shayakhmetov RR, Zhebrak A, Minaeva LI, Zagribelnyy BA, Lee LH, Soll R, Madge D, Xing L, Guo T, Aspuru-Guzik A. Zhavoronkov A, et al. Among authors: aspuru guzik a. Nat Biotechnol. 2019 Sep;37(9):1038-1040. doi: 10.1038/s41587-019-0224-x. Epub 2019 Sep 2. Nat Biotechnol. 2019. PMID: 31477924
QSAR without borders.
Muratov EN, Bajorath J, Sheridan RP, Tetko IV, Filimonov D, Poroikov V, Oprea TI, Baskin II, Varnek A, Roitberg A, Isayev O, Curtarolo S, Fourches D, Cohen Y, Aspuru-Guzik A, Winkler DA, Agrafiotis D, Cherkasov A, Tropsha A. Muratov EN, et al. Among authors: aspuru guzik a. Chem Soc Rev. 2020 Jun 7;49(11):3525-3564. doi: 10.1039/d0cs00098a. Epub 2020 May 1. Chem Soc Rev. 2020. PMID: 32356548 Review.
A thermodynamic atlas of carbon redox chemical space.
Jinich A, Sanchez-Lengeling B, Ren H, Goldford JE, Noor E, Sanders JN, Segrè D, Aspuru-Guzik A. Jinich A, et al. Among authors: aspuru guzik a. Proc Natl Acad Sci U S A. 2020 Dec 29;117(52):32910-32918. doi: 10.1073/pnas.2005642117. Epub 2020 Dec 21. Proc Natl Acad Sci U S A. 2020. PMID: 33376214 Free PMC article.
The Matter Simulation (R)evolution.
Aspuru-Guzik A, Lindh R, Reiher M. Aspuru-Guzik A, et al. ACS Cent Sci. 2018 Feb 28;4(2):144-152. doi: 10.1021/acscentsci.7b00550. Epub 2018 Feb 6. ACS Cent Sci. 2018. PMID: 29532014 Free PMC article. Review.
Charting a course for chemistry.
Aspuru-Guzik A, Baik MH, Balasubramanian S, Banerjee R, Bart S, Borduas-Dedekind N, Chang S, Chen P, Corminboeuf C, Coudert FX, Cronin L, Crudden C, Cuk T, Doyle AG, Fan C, Feng X, Freedman D, Furukawa S, Ghosh S, Glorius F, Jeffries-El M, Katsonis N, Li A, Linse SS, Marchesan S, Maulide N, Milo A, Narayan ARH, Naumov P, Nevado C, Nyokong T, Palacin R, Reid M, Robinson C, Robinson G, Sarpong R, Schindler C, Schlau-Cohen GS, Schmidt TW, Sessoli R, Shao-Horn Y, Sleiman H, Sutherland J, Taylor A, Tezcan A, Tortosa M, Walsh A, Watson AJB, Weckhuysen BM, Weiss E, Wilson D, Yam VW, Yang X, Ying JY, Yoon T, You SL, Zarbin AJG, Zhang H. Aspuru-Guzik A, et al. Nat Chem. 2019 Apr;11(4):286-294. doi: 10.1038/s41557-019-0236-7. Nat Chem. 2019. PMID: 30903035 No abstract available.
When robotics met fluidics.
Zhong J, Riordon J, Wu TC, Edwards H, Wheeler AR, Pardee K, Aspuru-Guzik A, Sinton D. Zhong J, et al. Among authors: aspuru guzik a. Lab Chip. 2020 Feb 21;20(4):709-716. doi: 10.1039/c9lc01042d. Epub 2020 Jan 2. Lab Chip. 2020. PMID: 31895394
qTorch: The quantum tensor contraction handler.
Fried ES, Sawaya NPD, Cao Y, Kivlichan ID, Romero J, Aspuru-Guzik A. Fried ES, et al. Among authors: aspuru guzik a. PLoS One. 2018 Dec 10;13(12):e0208510. doi: 10.1371/journal.pone.0208510. eCollection 2018. PLoS One. 2018. PMID: 30532242 Free PMC article.
Autonomous Molecular Design: Then and Now.
Dimitrov T, Kreisbeck C, Becker JS, Aspuru-Guzik A, Saikin SK. Dimitrov T, et al. Among authors: aspuru guzik a. ACS Appl Mater Interfaces. 2019 Jul 17;11(28):24825-24836. doi: 10.1021/acsami.9b01226. Epub 2019 Mar 25. ACS Appl Mater Interfaces. 2019. PMID: 30908004
197 results
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