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

Year Number of Results
2002 5
2003 3
2004 3
2005 3
2006 4
2007 8
2008 8
2009 5
2010 11
2011 6
2012 2
2013 6
2014 7
2015 7
2016 13
2017 16
2018 12
2019 13
2020 12
2021 15
2022 10
2023 19
2024 2

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169 results

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Page 1
Computational Design of Synthetic Enzymes.
Vaissier Welborn V, Head-Gordon T. Vaissier Welborn V, et al. Among authors: head gordon t. Chem Rev. 2019 Jun 12;119(11):6613-6630. doi: 10.1021/acs.chemrev.8b00399. Epub 2018 Oct 2. Chem Rev. 2019. PMID: 30277066 Review.
New developments in force fields for biomolecular simulations.
Nerenberg PS, Head-Gordon T. Nerenberg PS, et al. Among authors: head gordon t. Curr Opin Struct Biol. 2018 Apr;49:129-138. doi: 10.1016/j.sbi.2018.02.002. Epub 2018 Feb 22. Curr Opin Struct Biol. 2018. PMID: 29477047 Review.
Advanced Potential Energy Surfaces for Molecular Simulation.
Albaugh A, Boateng HA, Bradshaw RT, Demerdash ON, Dziedzic J, Mao Y, Margul DT, Swails J, Zeng Q, Case DA, Eastman P, Wang LP, Essex JW, Head-Gordon M, Pande VS, Ponder JW, Shao Y, Skylaris CK, Todorov IT, Tuckerman ME, Head-Gordon T. Albaugh A, et al. Among authors: head gordon t. J Phys Chem B. 2016 Sep 22;120(37):9811-32. doi: 10.1021/acs.jpcb.6b06414. J Phys Chem B. 2016. PMID: 27513316 Free PMC article. Review.
A benchmark dataset for Hydrogen Combustion.
Guan X, Das A, Stein CJ, Heidar-Zadeh F, Bertels L, Liu M, Haghighatlari M, Li J, Zhang O, Hao H, Leven I, Head-Gordon M, Head-Gordon T. Guan X, et al. Among authors: head gordon t. Sci Data. 2022 May 17;9(1):215. doi: 10.1038/s41597-022-01330-5. Sci Data. 2022. PMID: 35581204 Free PMC article.
Advanced potential energy surfaces for condensed phase simulation.
Demerdash O, Yap EH, Head-Gordon T. Demerdash O, et al. Among authors: head gordon t. Annu Rev Phys Chem. 2014;65:149-74. doi: 10.1146/annurev-physchem-040412-110040. Epub 2013 Dec 9. Annu Rev Phys Chem. 2014. PMID: 24328448 Review.
Molecular Properties and Chemical Transformations Near Interfaces.
Ahmed M, Blum M, Crumlin EJ, Geissler PL, Head-Gordon T, Limmer DT, Mandadapu KK, Saykally RJ, Wilson KR. Ahmed M, et al. Among authors: head gordon t. J Phys Chem B. 2021 Aug 19;125(32):9037-9051. doi: 10.1021/acs.jpcb.1c03756. Epub 2021 Aug 7. J Phys Chem B. 2021. PMID: 34365795
The birth and evolution of solvated electrons in the water.
Novelli F, Chen K, Buchmann A, Ockelmann T, Hoberg C, Head-Gordon T, Havenith M. Novelli F, et al. Among authors: head gordon t. Proc Natl Acad Sci U S A. 2023 Feb 21;120(8):e2216480120. doi: 10.1073/pnas.2216480120. Epub 2023 Feb 15. Proc Natl Acad Sci U S A. 2023. PMID: 36791104 Free PMC article.
Protein Dynamics to Define and Refine Disordered Protein Ensembles.
Naullage PM, Haghighatlari M, Namini A, Teixeira JMC, Li J, Zhang O, Gradinaru CC, Forman-Kay JD, Head-Gordon T. Naullage PM, et al. Among authors: head gordon t. J Phys Chem B. 2022 Mar 10;126(9):1885-1894. doi: 10.1021/acs.jpcb.1c10925. Epub 2022 Feb 25. J Phys Chem B. 2022. PMID: 35213160 Free PMC article.
The Energetic Origins of Pi-Pi Contacts in Proteins.
Carter-Fenk K, Liu M, Pujal L, Loipersberger M, Tsanai M, Vernon RM, Forman-Kay JD, Head-Gordon M, Heidar-Zadeh F, Head-Gordon T. Carter-Fenk K, et al. Among authors: head gordon t. J Am Chem Soc. 2023 Nov 2;145(45):24836-51. doi: 10.1021/jacs.3c09198. Online ahead of print. J Am Chem Soc. 2023. PMID: 37917924 Free PMC article.
169 results