Abstract
The main goal of this chapter is to provide a basis for understanding basic connections between NMR experiment and in silico computer simulation techniques. We outline the capability of modern theoretical approaches to assist with interpretation of experimental NMR data in terms of molecular structure. © 2006 Springer.
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Schöfberger, W., Sychrovský, V., & Trantírek, L. (2006). Quantum chemical calculations of NMR parameters. In Computational Studies of RNA and DNA (pp. 513–536). Springer Netherlands. https://doi.org/10.1007/978-1-4020-4851-3_20
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