[gmx-users] transition rate calculation

asaffarhi at post.tau.ac.il asaffarhi at post.tau.ac.il
Thu Aug 6 11:55:48 CEST 2015

Dear Aniko,

You can read


For equilibrium constant you can read


Best regards,

Quoting Lábas Anikó <labasaniko at gmail.com>:

> Dear Gromacs Users,
> Can You offer me any Gromacs tool which is intended to calculate reaction
> rate constant 'k' in mol/s? (For example the transitions of gas molecules
> from solvent to the protein and vice versa, using a given trajectory)
> Thank You in advance!
> Aniko
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