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

Year Number of Results
1965 1
1993 1
2003 1
2005 1
2006 3
2007 5
2008 1
2009 1
2011 1
2012 5
2013 5
2014 3
2015 3
2016 2
2017 7
2018 5
2019 1
2020 2
2023 0
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41 results
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Page 1
Q|R: quantum-based refinement.
Zheng M, Reimers JR, Waller MP, Afonine PV. Zheng M, et al. Among authors: waller mp. Acta Crystallogr D Struct Biol. 2017 Jan 1;73(Pt 1):45-52. doi: 10.1107/S2059798316019847. Epub 2017 Jan 1. Acta Crystallogr D Struct Biol. 2017. PMID: 28045384 Free PMC article.
Peptide-based carbohydrate receptors.
Rauschenberg M, Bandaru S, Waller MP, Ravoo BJ. Rauschenberg M, et al. Among authors: waller mp. Chemistry. 2014 Mar 3;20(10):2770-82. doi: 10.1002/chem.201303777. Chemistry. 2014. PMID: 24677356
Real-space quantum-based refinement for cryo-EM: Q|R#3.
Wang L, Kruse H, Sobolev OV, Moriarty NW, Waller MP, Afonine PV, Biczysko M. Wang L, et al. Among authors: waller mp. Acta Crystallogr D Struct Biol. 2020 Dec 1;76(Pt 12):1184-1191. doi: 10.1107/S2059798320013194. Epub 2020 Nov 19. Acta Crystallogr D Struct Biol. 2020. PMID: 33263324
Cooperativity in bimetallic glutathione complexes.
Kumbhar S, Jana S, Anoop A, Waller MP. Kumbhar S, et al. Among authors: waller mp. J Mol Graph Model. 2015 Nov;62:1-10. doi: 10.1016/j.jmgm.2015.05.003. Epub 2015 May 14. J Mol Graph Model. 2015. PMID: 26340533
Rational Density Functional Selection Using Game Theory.
McAnanama-Brereton S, Waller MP. McAnanama-Brereton S, et al. Among authors: waller mp. J Chem Inf Model. 2018 Jan 22;58(1):61-67. doi: 10.1021/acs.jcim.7b00542. Epub 2017 Dec 19. J Chem Inf Model. 2018. PMID: 29257687
Including crystallographic symmetry in quantum-based refinement: Q|R#2.
Zheng M, Biczysko M, Xu Y, Moriarty NW, Kruse H, Urzhumtsev A, Waller MP, Afonine PV. Zheng M, et al. Among authors: waller mp. Acta Crystallogr D Struct Biol. 2020 Jan 1;76(Pt 1):41-50. doi: 10.1107/S2059798319015122. Epub 2020 Jan 1. Acta Crystallogr D Struct Biol. 2020. PMID: 31909742
Yoink: An interaction-based partitioning API.
Zheng M, Waller MP. Zheng M, et al. Among authors: waller mp. J Comput Chem. 2018 May 15;39(13):799-806. doi: 10.1002/jcc.25146. Epub 2018 Jan 5. J Comput Chem. 2018. PMID: 29315651
41 results