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Perturbation Approach for Computing Infrared Spectra of the Local Mode of Probe Molecules
Linear and two-dimensional infrared (IR) spectroscopy of site-specific probe molecules provides an opportunity to gain a molecular-level understanding of the local hydrogen-bonding network, conformational dynamics, and long-range electrostatic interactions in condensed-phase and biological systems....
Tallennettuna:
| Julkaisussa: | J Chem Theory Comput |
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| Päätekijät: | , , , , , |
| Aineistotyyppi: | Artigo |
| Kieli: | Inglês |
| Julkaistu: |
2016
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| Aiheet: | |
| Linkit: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5793873/ https://ncbi.nlm.nih.gov/pubmed/28068771 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jctc.6b00733 |
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