Resonance Raman spectroscopy of cytochrome oxidase using Soret excitation: selective enhancement, indicator bands, and structural significance for cytochromes a and a3

Biochemistry ◽  
1981 ◽  
Vol 20 (5) ◽  
pp. 1332-1338 ◽  
Author(s):  
William H. Woodruff ◽  
Richard F. Dallinger ◽  
Toni M. Antalis ◽  
Graham Palmer
Molecules ◽  
2022 ◽  
Vol 27 (2) ◽  
pp. 442
Author(s):  
Sara Gómez ◽  
Natalia Rojas-Valencia ◽  
Tommaso Giovannini ◽  
Albeiro Restrepo ◽  
Chiara Cappelli

We unravel the potentialities of resonance Raman spectroscopy to detect ibuprofen in diluted aqueous solutions. In particular, we exploit a fully polarizable quantum mechanics/molecular mechanics (QM/MM) methodology based on fluctuating charges coupled to molecular dynamics (MD) in order to take into account the dynamical aspects of the solvation phenomenon. Our findings, which are discussed in light of a natural bond orbital (NBO) analysis, reveal that a selective enhancement of the Raman signal due to the normal mode associated with the C–C stretching in the ring, νC=C, can be achieved by properly tuning the incident wavelength, thus facilitating the recognition of ibuprofen in water samples.


Author(s):  
William H. Woodruff ◽  
Richard F. Dallinger ◽  
Toni M. Antalis ◽  
Graham Palmer

FEBS Letters ◽  
1985 ◽  
Vol 182 (2) ◽  
pp. 375-379 ◽  
Author(s):  
Robert A. Copeland ◽  
Ali Naquit Britton Chance ◽  
Thomas G. Spiro

1984 ◽  
Vol 106 (26) ◽  
pp. 8305-8306 ◽  
Author(s):  
Gerald T. Babcock ◽  
John M. Jean ◽  
Leah N. Johnston ◽  
Graham Palmer ◽  
William H. Woodruff

1993 ◽  
Vol 51 (1-2) ◽  
pp. 241
Author(s):  
T. Ogura ◽  
S. Takahashi ◽  
S. Hirota ◽  
K. Shinzawa-Itoh ◽  
S. Yoshikawa ◽  
...  

Sign in / Sign up

Export Citation Format

Share Document