[gmx-users] Position Constraint

[Mark Abraham]

Jae Hyun Park wrote:
> Dear GROMACS users,
> 
> I would like to modify the source code on the position restraint part (restraining the atoms in a protein using -DPOSRES). Could anybody let me know where (or which subroutine) I can do it?

grep "[Rr]estraint" src/*/*.[ch] | grep "[Pp]osition"

will probably give you some starting points.

Mark