[gmx-users] Proton transfer reaction in gromacs

[Padmani Sandhu]

Hello,


I want to study proton transfer reaction in a protein channel using
gromacs. I read in the literature that it is not possible to do this by
classical MD, then what are the other ways to perform it in gromacs..??

-- 
*Padmani sandhu*
*Research Scholar,*
*Center for Computational Biology and Bioinformatics,*
*Central University of Himachal Pradesh,*
*Temporary Academic Block, Shahpur *
*Pin 176206, District Kangra,*
*Himachal Pradesh, India*