Smith JC - Search Results

1

Evidence for Osteocalcin Binding and Activation of GPRC6A in β-Cells.

Pi M, Kapoor K, Ye R, Nishimoto SK, Smith JC, Baudry J, Quarles LD. Pi M, et al. Among authors: smith jc. Endocrinology. 2016 May;157(5):1866-80. doi: 10.1210/en.2015-2010. Epub 2016 Mar 23. Endocrinology. 2016. PMID: 27007074 Free PMC article.

2

Can proteins and crystals self-catalyze methyl rotations?

Baudry J, Smith JC. Baudry J, et al. Among authors: smith jc. J Phys Chem B. 2005 Nov 3;109(43):20572-8. doi: 10.1021/jp053111z. J Phys Chem B. 2005. PMID: 16853663

3

Key role of active-site water molecules in bacteriorhodopsin proton-transfer reactions.

Bondar AN, Baudry J, Suhai S, Fischer S, Smith JC. Bondar AN, et al. Among authors: smith jc. J Phys Chem B. 2008 Nov 27;112(47):14729-41. doi: 10.1021/jp801916f. J Phys Chem B. 2008. PMID: 18973373

4

Task-parallel message passing interface implementation of Autodock4 for docking of very large databases of compounds using high-performance super-computers.

Collignon B, Schulz R, Smith JC, Baudry J. Collignon B, et al. Among authors: smith jc. J Comput Chem. 2011 Apr 30;32(6):1202-9. doi: 10.1002/jcc.21696. Epub 2010 Dec 7. J Comput Chem. 2011. PMID: 21387347

5

Derivation of mean-square displacements for protein dynamics from elastic incoherent neutron scattering.

Yi Z, Miao Y, Baudry J, Jain N, Smith JC. Yi Z, et al. Among authors: smith jc. J Phys Chem B. 2012 Apr 26;116(16):5028-36. doi: 10.1021/jp2102868. Epub 2012 Apr 13. J Phys Chem B. 2012. PMID: 22471396

6

Temperature-dependent dynamical transitions of different classes of amino acid residue in a globular protein.

Miao Y, Yi Z, Glass DC, Hong L, Tyagi M, Baudry J, Jain N, Smith JC. Miao Y, et al. Among authors: smith jc. J Am Chem Soc. 2012 Dec 5;134(48):19576-9. doi: 10.1021/ja3097898. Epub 2012 Nov 20. J Am Chem Soc. 2012. PMID: 23140218

7

Coupled flexibility change in cytochrome P450cam substrate binding determined by neutron scattering, NMR, and molecular dynamics simulation.

Miao Y, Yi Z, Cantrell C, Glass DC, Baudry J, Jain N, Smith JC. Miao Y, et al. Among authors: smith jc. Biophys J. 2012 Nov 21;103(10):2167-76. doi: 10.1016/j.bpj.2012.10.013. Epub 2012 Nov 20. Biophys J. 2012. PMID: 23200050 Free PMC article.

8

Three entropic classes of side chain in a globular protein.

Glass DC, Krishnan M, Smith JC, Baudry J. Glass DC, et al. Among authors: smith jc. J Phys Chem B. 2013 Mar 21;117(11):3127-34. doi: 10.1021/jp400564q. Epub 2013 Mar 8. J Phys Chem B. 2013. PMID: 23421556

9

VinaMPI: facilitating multiple receptor high-throughput virtual docking on high-performance computers.

Ellingson SR, Smith JC, Baudry J. Ellingson SR, et al. Among authors: smith jc. J Comput Chem. 2013 Sep 30;34(25):2212-21. doi: 10.1002/jcc.23367. J Comput Chem. 2013. PMID: 23813626

10

Accelerating Virtual High-Throughput Ligand Docking: current technology and case study on a petascale supercomputer.

Ellingson SR, Dakshanamurthy S, Brown M, Smith JC, Baudry J. Ellingson SR, et al. Among authors: smith jc. Concurr Comput. 2014 Apr 25;26(6):1268-1277. doi: 10.1002/cpe.3070. Concurr Comput. 2014. PMID: 24729746 Free PMC article.

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