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

Year Number of Results
2005 2
2007 3
2008 4
2009 7
2010 4
2011 4
2012 10
2013 7
2014 10
2015 11
2016 20
2017 17
2018 16
2019 16
2020 29
2021 22
2022 21
2023 13
2024 2

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201 results

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Page 1
A Celebration of Women in Computational Chemistry.
Wahab HA, Amaro RE, Cournia Z. Wahab HA, et al. Among authors: amaro re. J Chem Inf Model. 2019 May 28;59(5):1683-1692. doi: 10.1021/acs.jcim.9b00368. J Chem Inf Model. 2019. PMID: 31132853 No abstract available.
Advancing Women in Chemistry.
Cournia Z, Soares TA, Wahab HA, Amaro RE. Cournia Z, et al. Among authors: amaro re. J Chem Inf Model. 2021 Nov 22;61(11):5305-5306. doi: 10.1021/acs.jcim.1c01185. Epub 2021 Oct 20. J Chem Inf Model. 2021. PMID: 34668709 No abstract available.
Spike-heparan sulfate interactions in SARS-CoV-2 infection.
Kearns FL, Sandoval DR, Casalino L, Clausen TM, Rosenfeld MA, Spliid CB, Amaro RE, Esko JD. Kearns FL, et al. Among authors: amaro re. Curr Opin Struct Biol. 2022 Oct;76:102439. doi: 10.1016/j.sbi.2022.102439. Epub 2022 Jul 6. Curr Opin Struct Biol. 2022. PMID: 35926454 Free PMC article. Review.
Transmissible SARS-CoV-2 variants with resistance to clinical protease inhibitors.
Moghadasi SA, Heilmann E, Khalil AM, Nnabuife C, Kearns FL, Ye C, Moraes SN, Costacurta F, Esler MA, Aihara H, von Laer D, Martinez-Sobrido L, Palzkill T, Amaro RE, Harris RS. Moghadasi SA, et al. Among authors: amaro re. Sci Adv. 2023 Mar 29;9(13):eade8778. doi: 10.1126/sciadv.ade8778. Epub 2023 Mar 29. Sci Adv. 2023. PMID: 36989354 Free PMC article.
Ensemble Docking in Drug Discovery.
Amaro RE, Baudry J, Chodera J, Demir Ö, McCammon JA, Miao Y, Smith JC. Amaro RE, et al. Biophys J. 2018 May 22;114(10):2271-2278. doi: 10.1016/j.bpj.2018.02.038. Epub 2018 Mar 30. Biophys J. 2018. PMID: 29606412 Free PMC article. Review.
Glycoproteomic landscape and structural dynamics of TIM family immune checkpoints enabled by mucinase SmE.
Chongsaritsinsuk J, Steigmeyer AD, Mahoney KE, Rosenfeld MA, Lucas TM, Smith CM, Li A, Ince D, Kearns FL, Battison AS, Hollenhorst MA, Judy Shon D, Tiemeyer KH, Attah V, Kwon C, Bertozzi CR, Ferracane MJ, Lemmon MA, Amaro RE, Malaker SA. Chongsaritsinsuk J, et al. Among authors: amaro re. Nat Commun. 2023 Oct 4;14(1):6169. doi: 10.1038/s41467-023-41756-y. Nat Commun. 2023. PMID: 37794035 Free PMC article.
Multiscale simulation approaches to modeling drug-protein binding.
Jagger BR, Kochanek SE, Haldar S, Amaro RE, Mulholland AJ. Jagger BR, et al. Among authors: amaro re. Curr Opin Struct Biol. 2020 Apr;61:213-221. doi: 10.1016/j.sbi.2020.01.014. Epub 2020 Feb 26. Curr Opin Struct Biol. 2020. PMID: 32113133 Review.
Targeted protein S-nitrosylation of ACE2 inhibits SARS-CoV-2 infection.
Oh CK, Nakamura T, Beutler N, Zhang X, Piña-Crespo J, Talantova M, Ghatak S, Trudler D, Carnevale LN, McKercher SR, Bakowski MA, Diedrich JK, Roberts AJ, Woods AK, Chi V, Gupta AK, Rosenfeld MA, Kearns FL, Casalino L, Shaabani N, Liu H, Wilson IA, Amaro RE, Burton DR, Yates JR 3rd, Becker C, Rogers TF, Chatterjee AK, Lipton SA. Oh CK, et al. Among authors: amaro re. Nat Chem Biol. 2023 Mar;19(3):275-283. doi: 10.1038/s41589-022-01149-6. Epub 2022 Sep 29. Nat Chem Biol. 2023. PMID: 36175661 Free PMC article.
Women in Computational Chemistry.
Wahab HA, Amaro RE, Cournia Z. Wahab HA, et al. Among authors: amaro re. J Chem Inf Model. 2018 Nov 26;58(11):2175-2177. doi: 10.1021/acs.jcim.8b00642. Epub 2018 Oct 2. J Chem Inf Model. 2018. PMID: 30277769 No abstract available.
Gaussian Accelerated Molecular Dynamics in OpenMM.
Copeland MM, Do HN, Votapka L, Joshi K, Wang J, Amaro RE, Miao Y. Copeland MM, et al. Among authors: amaro re. J Phys Chem B. 2022 Aug 11;126(31):5810-5820. doi: 10.1021/acs.jpcb.2c03765. Epub 2022 Jul 27. J Phys Chem B. 2022. PMID: 35895977 Free PMC article.
201 results