[gmx-users] H2O close to N-terms

[Mark Abraham]

rodrid3 at rpi.edu wrote:
> 
>   Someone has written a script to calculate how may times H2O molecules
> get really close or bind to the N-terminals of a protein?(it's outer
> part, not the core) Or maybe someone nows how to calculate the N-terms
> interactions with the solvent? Anything related to this would help. 

See g_mindist in the manual.

Mark