CHARMM-GUI DEER facilitator for spin-pair distance distribution calculations and preparation of restrained-ensemble molecular dynamics simulations

Yifei Qi, Jumin Lee, Xi Cheng, Rong Shen, Shahidul M. Islam, Benoît Roux, Wonpil Im. CHARMM-GUI DEER facilitator for spin-pair distance distribution calculations and preparation of restrained-ensemble molecular dynamics simulations. Journal of Computational Chemistry, 41(5):415-420, 2020. [doi]

@article{QiLCSIRI20,
  title = {CHARMM-GUI DEER facilitator for spin-pair distance distribution calculations and preparation of restrained-ensemble molecular dynamics simulations},
  author = {Yifei Qi and Jumin Lee and Xi Cheng and Rong Shen and Shahidul M. Islam and Benoît Roux and Wonpil Im},
  year = {2020},
  doi = {10.1002/jcc.26032},
  url = {https://doi.org/10.1002/jcc.26032},
  researchr = {https://researchr.org/publication/QiLCSIRI20},
  cites = {0},
  citedby = {0},
  journal = {Journal of Computational Chemistry},
  volume = {41},
  number = {5},
  pages = {415-420},
}