[gmx-users] Help regarding applying constraint on individual molecule in a system

anupama sharma anusharma.jan1995 at gmail.com
Fri Feb 1 16:24:33 CET 2019


Dear user's,
    I need help regarding constraint. I am doing simulation of water (
tip4p/2005) and carbon nanotube and want to put constraint only on carbon
nanotube as after nvt simulation I had observed that carbon nanotube is
getting deformed.


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