Corcelli SA - Search Results

1

Computational Study of Phosphate Vibrations as Reporters of DNA Hydration.

Floisand DJ, Corcelli SA. Floisand DJ, et al. Among authors: corcelli sa. J Phys Chem Lett. 2015 Oct 15;6(20):4012-7. doi: 10.1021/acs.jpclett.5b01973. Epub 2015 Sep 24. J Phys Chem Lett. 2015. PMID: 26722770

2

Infrared and Raman line shapes of dilute HOD in liquid H2O and D2O from 10 to 90 degrees C.

Corcelli SA, Skinner JL. Corcelli SA, et al. J Phys Chem A. 2005 Jul 21;109(28):6154-65. doi: 10.1021/jp0506540. J Phys Chem A. 2005. PMID: 16833955

3

Solvation dynamics of Hoechst 33258 in water: an equilibrium and nonequilibrium molecular dynamics study.

Furse KE, Lindquist BA, Corcelli SA. Furse KE, et al. Among authors: corcelli sa. J Phys Chem B. 2008 Mar 13;112(10):3231-9. doi: 10.1021/jp711100f. Epub 2008 Feb 14. J Phys Chem B. 2008. PMID: 18271577

4

Nitrile groups as vibrational probes: calculations of the CN infrared absorption line shape of acetonitrile in water and tetrahydrofuran.

Lindquist BA, Corcelli SA. Lindquist BA, et al. Among authors: corcelli sa. J Phys Chem B. 2008 May 22;112(20):6301-3. doi: 10.1021/jp802039e. Epub 2008 Apr 26. J Phys Chem B. 2008. PMID: 18438998

5

The dynamics of water at DNA interfaces: computational studies of Hoechst 33258 bound to DNA.

Furse KE, Corcelli SA. Furse KE, et al. Among authors: corcelli sa. J Am Chem Soc. 2008 Oct 1;130(39):13103-9. doi: 10.1021/ja803728g. Epub 2008 Sep 4. J Am Chem Soc. 2008. PMID: 18767841

6

Optimized quantum mechanics/molecular mechanics strategies for nitrile vibrational probes: acetonitrile and para-tolunitrile in water and tetrahydrofuran.

Lindquist BA, Haws RT, Corcelli SA. Lindquist BA, et al. Among authors: corcelli sa. J Phys Chem B. 2008 Nov 6;112(44):13991-4001. doi: 10.1021/jp804900u. Epub 2008 Oct 15. J Phys Chem B. 2008. PMID: 18855431

7

Carbon-deuterium vibrational probes of amino acid protonation state.

Miller CS, Corcelli SA. Miller CS, et al. Among authors: corcelli sa. J Phys Chem B. 2009 Jun 18;113(24):8218-21. doi: 10.1021/jp903520s. J Phys Chem B. 2009. PMID: 19463012

8

Nitrile groups as vibrational probes of biomolecular structure and dynamics: an overview.

Lindquist BA, Furse KE, Corcelli SA. Lindquist BA, et al. Among authors: corcelli sa. Phys Chem Chem Phys. 2009 Oct 1;11(37):8119-32. doi: 10.1039/b908588b. Epub 2009 Jul 31. Phys Chem Chem Phys. 2009. PMID: 19756266 Review.

9

Carbon-deuterium vibrational probes of the protonation state of histidine in the gas-phase and in aqueous solution.

Miller CS, Corcelli SA. Miller CS, et al. Among authors: corcelli sa. J Phys Chem B. 2010 Jul 1;114(25):8565-73. doi: 10.1021/jp1028596. J Phys Chem B. 2010. PMID: 20524690

10

Effects of an unnatural base pair replacement on the structure and dynamics of DNA and neighboring water and ions.

Furse KE, Corcelli SA. Furse KE, et al. Among authors: corcelli sa. J Phys Chem B. 2010 Aug 5;114(30):9934-45. doi: 10.1021/jp105761b. J Phys Chem B. 2010. PMID: 20614919

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