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

Year Number of Results
2001 1
2005 2
2007 3
2008 4
2009 7
2010 4
2011 4
2012 10
2013 7
2014 10
2015 11
2016 21
2017 18
2018 17
2019 16
2020 30
2021 22
2022 21
2023 13
2024 5

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208 results

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Page 1
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.
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.
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.
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.
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.
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.
A Reflection on Klaus Schulten.
Amaro RE. Amaro RE. J Chem Theory Comput. 2017 Jan 10;13(1):1-2. doi: 10.1021/acs.jctc.6b01111. Epub 2016 Dec 6. J Chem Theory Comput. 2017. PMID: 28068772 No abstract available.
Computational approaches to mapping allosteric pathways.
Feher VA, Durrant JD, Van Wart AT, Amaro RE. Feher VA, et al. Among authors: amaro re. Curr Opin Struct Biol. 2014 Apr;25:98-103. doi: 10.1016/j.sbi.2014.02.004. Epub 2014 Mar 22. Curr Opin Struct Biol. 2014. PMID: 24667124 Free PMC article. Review.
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.
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.
208 results