Benchmarking quantum mechanical calculations with experimental NMR chemical shifts of 2-HADNT
Author:
Publisher
Elsevier BV
Subject
Inorganic Chemistry,Organic Chemistry,Spectroscopy,Analytical Chemistry
Reference53 articles.
1. Ab Initio Methods for the Calculation of NMR Shielding and Indirect Spin−Spin Coupling Constants
2. Ab initiocalculations of NMR chemical shifts
3. NMR chemical shift data and ab initio shielding calculations: emerging tools for protein structure determination
4. Carbon-13 NMR Shielding in the Twenty Common Amino Acids: Comparisons with Experimental Results in Proteins
5. Toward direct determination of conformations of protein building units from multidimensional NMR experiments I. A theoretical case study of For-Gly-NH2 and For-L-Ala-NH2
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