Simulation of Infrared Spectra for β-Hairpin Peptides Stabilized by an Aib-Gly Turn Sequence: Correlation between Conformational Fluctuation and Vibrational Coupling-Reference-Cited by-同舟云学术

Simulation of Infrared Spectra for β-Hairpin Peptides Stabilized by an Aib-Gly Turn Sequence: Correlation between Conformational Fluctuation and Vibrational Coupling

Published:2006-10-25 Issue:46 Volume:110 Page:23590-23602
ISSN:1520-6106
Container-title:The Journal of Physical Chemistry B
language:en
Short-container-title:J. Phys. Chem. B

Author:

Kim Joohyun¹,Huang Rong¹,Kubelka Jan¹,Bouř Petr¹,Keiderling Timothy A.¹

Affiliation:

1. Department of Chemistry, University of Illinois at Chicago, 845 West Taylor Street, Chicago, Illinois 60607-7061, and Institute for Organic Chemistry and Biochemistry, Academy of Science of the Czech Republic, Flemingovo nam. 2, 16610, Praha 6, Czech Republic

Publisher

American Chemical Society (ACS)

Subject

Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp0640575

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3. Ab Initio Prediction of Vibrational Absorption and Circular Dichroism Spectra of Chiral Natural Products Using Density Functional Theory: α-Pinene

4. Ab initio calculation of atomic axial tensors and vibrational rotational strengths using density functional theory

5. What vibrations tell about proteins

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