[gmx-users] Position Restraint for production MD

Pandya, Akash akash.pandya.15 at ucl.ac.uk
Mon Aug 14 13:48:34 CEST 2017


Hi all,

I want to apply position restraints onto a bond for production MD, so that my protein does not go outside the simulation box during the MD run. Is this possible? And if so how would I go about doing this? Your suggestions will be much appreciated.

Akash


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