Phillip S. Hudson, Kyungreem Han, H. Lee Woodcock III, Bernard R. Brooks. Force matching as a stepping stone to QM/MM CB[8] host/guest binding free energies: a SAMPL6 cautionary tale. Journal of Computer-Aided Molecular Design, 32(10):983-999, 2018. [doi]
@article{HudsonHWB18,
title = {Force matching as a stepping stone to QM/MM CB[8] host/guest binding free energies: a SAMPL6 cautionary tale},
author = {Phillip S. Hudson and Kyungreem Han and H. Lee Woodcock III and Bernard R. Brooks},
year = {2018},
doi = {10.1007/s10822-018-0165-3},
url = {https://doi.org/10.1007/s10822-018-0165-3},
researchr = {https://researchr.org/publication/HudsonHWB18},
cites = {0},
citedby = {0},
journal = {Journal of Computer-Aided Molecular Design},
volume = {32},
number = {10},
pages = {983-999},
}