@article{TEXTUAL,
      recid = {13501},
      author = {Liu, Yu and Li, Chenghan and Voth, Gregory A.},
      title = {Generalized Transition State Theory Treatment of  Water-Assisted Proton Transport Processes in Proteins},
      journal = {The Journal of Physical Chemistry B},
      address = {2022-12-02},
      number = {TEXTUAL},
      abstract = {Transition state theory (TST) is widely employed for  estimating the transition rate of a reaction when combined  with free energy sampling techniques. A derivation of the  transition theory rate expression for a general  n-dimensional case is presented in this work which  specifically focuses on water-assisted proton  transfer/transport reactions, especially for protein  systems. Our work evaluates the TST prefactor calculated at  the transition state dividing surface compared to one  sampled, as an approximation, in the reactant state in four  case studies of water-assisted proton transport inside  membrane proteins and highlights the significant impact of  the prefactor position dependence in proton transport  processes.},
      url = {http://knowledge.uchicago.edu/record/13501},
}