Improved Modeling of Cation-π and Anion-Ring Interactions Using the Drude Polarizable Empirical Force Field for Proteins

Fang-Yu Lin, Alexander D. MacKerell Jr.. Improved Modeling of Cation-π and Anion-Ring Interactions Using the Drude Polarizable Empirical Force Field for Proteins. Journal of Computational Chemistry, 41(5):439-448, 2020. [doi]

@article{LinM20,
  title = {Improved Modeling of Cation-π and Anion-Ring Interactions Using the Drude Polarizable Empirical Force Field for Proteins},
  author = {Fang-Yu Lin and Alexander D. MacKerell Jr.},
  year = {2020},
  doi = {10.1002/jcc.26067},
  url = {https://doi.org/10.1002/jcc.26067},
  researchr = {https://researchr.org/publication/LinM20},
  cites = {0},
  citedby = {0},
  journal = {Journal of Computational Chemistry},
  volume = {41},
  number = {5},
  pages = {439-448},
}