迈向大分子的拉曼光学活性计算 - Suppr

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超能文献

Towards Raman optical activity calculations of large molecules.

作者信息

Zuber Gérard, Goldsmith Michael-Rock, Beratan David N, Wipf Peter

机构信息

Department of Chemistry, Duke University, Durham, North Carolina 27708, USA.

出版信息

Chemphyschem. 2005 Apr;6(4):595-7. doi: 10.1002/cphc.200400544.

DOI:10.1002/cphc.200400544

PMID:15881572

Abstract

摘要

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Towards Raman optical activity calculations of large molecules.

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引用本文的文献

Optical signatures of molecular dissymmetry: combining theory with experiments to address stereochemical puzzles.

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Towards Raman optical activity calculations of large molecules.

作者信息

Zuber Gérard, Goldsmith Michael-Rock, Beratan David N, Wipf Peter

机构信息

Department of Chemistry, Duke University, Durham, North Carolina 27708, USA.

出版信息

Chemphyschem. 2005 Apr;6(4):595-7. doi: 10.1002/cphc.200400544.

DOI:10.1002/cphc.200400544

PMID:15881572

Abstract

摘要

相似文献

Towards Raman optical activity calculations of large molecules.

Chemphyschem. 2005 Apr;6(4):595-7. doi: 10.1002/cphc.200400544.

Symmetry properties of vibrational modes in mesoporphyrin IX dimethyl ester investigated by polarization-sensitive resonance Raman and CARS spectroscopy.

J Phys Chem A. 2006 Oct 5;110(39):11252-9. doi: 10.1021/jp062864y.

Raman mapping and in situ SERS spectroelectrochemical studies of 6-mercaptopurine SAMs on the gold electrode.

J Phys Chem B. 2005 Feb 24;109(7):2739-44. doi: 10.1021/jp046082l.

Time-dependent picture of the charge-transfer contributions to surface enhanced Raman spectroscopy.

J Chem Phys. 2007 Jun 28;126(24):244709. doi: 10.1063/1.2748386.

Theoretical study on the circular dichroism in core and valence photoelectron angular distributions of camphor enantiomers.

J Chem Phys. 2006 Jan 14;124(2):024326. doi: 10.1063/1.2150438.

Can Raman optical activity separate axial from local chirality? A theoretical study of helical deca-alanine.

Chemphyschem. 2006 Oct 13;7(10):2189-96. doi: 10.1002/cphc.200600391.

Can the light scattering depolarization ratio of small particles be greater than 1/3?

J Phys Chem B. 2005 Jul 21;109(28):13578-84. doi: 10.1021/jp0521095.

Structure of endohedral fullerene Eu@C74.

Phys Chem Chem Phys. 2009 Aug 14;11(30):6353-8. doi: 10.1039/b902098e. Epub 2009 Jun 10.

Resonance Raman studies of beta-substituted porphyrin systems with unusual electronic absorption properties.

Chemphyschem. 2006 Nov 13;7(11):2358-65. doi: 10.1002/cphc.200600423.

Vibrational properties of inclusion complexes: the case of indomethacin-cyclodextrin.

J Chem Phys. 2006 Jul 28;125(4):44511. doi: 10.1063/1.2217952.

引用本文的文献

Optical signatures of molecular dissymmetry: combining theory with experiments to address stereochemical puzzles.

Acc Chem Res. 2009 Jun 16;42(6):809-19. doi: 10.1021/ar8002859.

Characterizing aqueous solution conformations of a peptide backbone using Raman optical activity computations.

Biophys J. 2008 Dec 15;95(12):5574-86. doi: 10.1529/biophysj.108.137596. Epub 2008 Sep 19.