Direct Calculations of Mid- and Near-IR Absorption and Circular Dichroism Spectra of Chiral Molecules Using QM/MM Molecular Dynamics Simulation Method
Author:
Affiliation:
1. Department of Chemistry, Korea University, Seoul 136-701, Korea
2. Multidimensional Spectroscopy Laboratory, Korea Basic Science Institute, Seoul 1360-713, Korea
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/ct200660s
Reference55 articles.
1. Atmospheric Photochemistry via Vibrational Overtone Absorption
2. Progress of near-infrared spectroscopy and topography for brain and muscle clinical applications
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