Using either Raman or NIR spectroscopy, I'm interested in trying to
calculate the energies (or magnitudes) associated with the absorption
bands for glucose and other molecules. We'd like to be able to predict
these energies in order to determine which molecules might contribute to
the spectra of glucose. Does anyone know of work being done in this
area? Or possibly some equation to calculate these energies? Any help
would be greatly appreciated!
rwhiton at ucsd.edu