@misc{indiciae8edc93a8080f,
  title = {gmxapi: a Gromacs-native Python interface for molecular dynamics with ensemble and plugin support},
  author = {Irrgang, M. E. and Davis, C. and Kasson, P.},
  year = {2021},
  doi = {10.1101/2021.07.18.452496},
  url = {https://www.biorxiv.org/content/10.1101/2021.07.18.452496v1},
  note = {Source identifier: 10.1101/2021.07.18.452496}
}