Ching Ching Lam, Jonathan M. Goodman. CONFPASS: Fast DFT Re-Optimizations of Structures from Conformation Searches. Journal of Chemical Information and Computer Sciences, 63(14):4364-4375, July 2023. [doi]
@article{LamG23,
title = {CONFPASS: Fast DFT Re-Optimizations of Structures from Conformation Searches},
author = {Ching Ching Lam and Jonathan M. Goodman},
year = {2023},
month = {July},
doi = {10.1021/acs.jcim.3c00649},
url = {https://doi.org/10.1021/acs.jcim.3c00649},
researchr = {https://researchr.org/publication/LamG23},
cites = {0},
citedby = {0},
journal = {Journal of Chemical Information and Computer Sciences},
volume = {63},
number = {14},
pages = {4364-4375},
}