Haochuan Chen, Julio D. C. Maia, Brian K. Radak, David J. Hardy, Wensheng Cai, Christophe Chipot, Emad Tajkhorshid. Boosting Free-Energy Perturbation Calculations with GPU-Accelerated NAMD. Journal of Chemical Information and Computer Sciences, 60(11):5301-5307, 2020. [doi]
@article{ChenMRHCCT20,
title = {Boosting Free-Energy Perturbation Calculations with GPU-Accelerated NAMD},
author = {Haochuan Chen and Julio D. C. Maia and Brian K. Radak and David J. Hardy and Wensheng Cai and Christophe Chipot and Emad Tajkhorshid},
year = {2020},
doi = {10.1021/acs.jcim.0c00745},
url = {https://doi.org/10.1021/acs.jcim.0c00745},
researchr = {https://researchr.org/publication/ChenMRHCCT20},
cites = {0},
citedby = {0},
journal = {Journal of Chemical Information and Computer Sciences},
volume = {60},
number = {11},
pages = {5301-5307},
}