Multiscale Workflow for Modeling Ligand Complexes of Zinc Metalloproteins

Zongfan Yang, Rebecca M. Twidale, Silvia Gervasoni, Reynier Suardíaz, Charlotte K. Colenso, Eric J. M. Lang, James Spencer, Adrian J. Mulholland. Multiscale Workflow for Modeling Ligand Complexes of Zinc Metalloproteins. Journal of Chemical Information and Computer Sciences, 61(11):5658-5672, 2021. [doi]

@article{YangTGSCLSM21,
  title = {Multiscale Workflow for Modeling Ligand Complexes of Zinc Metalloproteins},
  author = {Zongfan Yang and Rebecca M. Twidale and Silvia Gervasoni and Reynier Suardíaz and Charlotte K. Colenso and Eric J. M. Lang and James Spencer and Adrian J. Mulholland},
  year = {2021},
  doi = {10.1021/acs.jcim.1c01109},
  url = {https://doi.org/10.1021/acs.jcim.1c01109},
  researchr = {https://researchr.org/publication/YangTGSCLSM21},
  cites = {0},
  citedby = {0},
  journal = {Journal of Chemical Information and Computer Sciences},
  volume = {61},
  number = {11},
  pages = {5658-5672},
}