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Year Number of Results
1991 2
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1996 1
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1998 1
1999 3
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2002 5
2003 3
2004 3
2005 3
2006 4
2007 8
2008 8
2009 5
2010 13
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2016 13
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200 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.
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.
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.
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.
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
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.
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.
Finding Our Way in the Dark Proteome.
Bhowmick A, Brookes DH, Yost SR, Dyson HJ, Forman-Kay JD, Gunter D, Head-Gordon M, Hura GL, Pande VS, Wemmer DE, Wright PE, Head-Gordon T. Bhowmick A, et al. Among authors: head gordon t. J Am Chem Soc. 2016 Aug 10;138(31):9730-42. doi: 10.1021/jacs.6b06543. Epub 2016 Jul 19. J Am Chem Soc. 2016. PMID: 27387657 Free PMC article.
200 results