Yan Liu, Tao Zhou, Jun-Cheng Cao,
https://www.sciencedirect.com/science/article/pii/S1350449518307102
The absorption spectra of four amino acids were studied. These spectra are obtained by terahertz time-domain spectroscopy (TDS) technique. The four amino acids are alanine, methionine, leucine, and valine, respectively. The spectra of their enantiomers (L-, D-) and racemic compounds (DL-) were investigated. Although the two isomers have very similar structures, their absorption spectra are obviously different. The absorption coefficient of each structure is calculated by the density functional theory (DFT), and the simulated spectra of each structure are obtained. It is shown that the number of the calculated peaks is in good agreement with the experimental ones. The experimental spectra were compared with the theoretical spectra. The differences between the absorption spectra of isomers are presented, and the reasons for the differences were analyzed. The vibratory spectra of biomolecules were studied, and the correlation between molecular structure and function was further understood.
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