[gmx-users] Define Heavy Water

xy21hb xy21hb at 163.com
Mon Dec 1 17:12:30 CET 2014


Dear all,


In ffnonbonde.itp, there is a "ifdef HEAVY_H",
I wonder how I can use it.


I tried "define=HEAVY_H" in .top or .mdp,
but neither works.


I just wanna simulate heavy water system.


Best,


Yao


More information about the gromacs.org_gmx-users mailing list