@article{doi:10.1063/5.0084833,
author = {Hruska,Eugen  and Gale,Ariel  and Huang,Xiao  and Liu,Fang },
title = {AutoSolvate: A toolkit for automating quantum chemistry design and discovery of solvated molecules},
journal = {The Journal of Chemical Physics},
volume = {156},
number = {12},
pages = {124801},
year = {2022},
doi = {10.1063/5.0084833},

URL = { 
        https://doi.org/10.1063/5.0084833
    
},
eprint = { 
        https://doi.org/10.1063/5.0084833
    
}

}