Rong-Zhen Liao, Walter Thiel. Convergence in the QM-only and QM/MM modeling of enzymatic reactions: A case study for acetylene hydratase. Journal of Computational Chemistry, 34(27):2389-2397, 2013. [doi]
@article{LiaoT13,
title = {Convergence in the QM-only and QM/MM modeling of enzymatic reactions: A case study for acetylene hydratase},
author = {Rong-Zhen Liao and Walter Thiel},
year = {2013},
doi = {10.1002/jcc.23403},
url = {http://dx.doi.org/10.1002/jcc.23403},
researchr = {https://researchr.org/publication/LiaoT13},
cites = {0},
citedby = {0},
journal = {Journal of Computational Chemistry},
volume = {34},
number = {27},
pages = {2389-2397},
}