Seongho Moon, David A. Case. A comparison of quantum chemical models for calculating NMR shielding parameters in peptides: Mixed basis set and ONIOM methods combined with a complete basis set extrapolation. Journal of Computational Chemistry, 27(7):825-836, 2006. [doi]
@article{MoonC06:1,
title = {A comparison of quantum chemical models for calculating NMR shielding parameters in peptides: Mixed basis set and ONIOM methods combined with a complete basis set extrapolation},
author = {Seongho Moon and David A. Case},
year = {2006},
doi = {10.1002/jcc.20388},
url = {http://dx.doi.org/10.1002/jcc.20388},
tags = {completeness},
researchr = {https://researchr.org/publication/MoonC06%3A1},
cites = {0},
citedby = {0},
journal = {Journal of Computational Chemistry},
volume = {27},
number = {7},
pages = {825-836},
}