[gmx-users] tc-groups in mdp file

Amali Guruge amaligg2010 at gmail.com
Tue Oct 24 08:47:28 CEST 2017

Dear gmx users,

My system contains ~ 700 polyethylene glycol (PEG) molecules and ~96000
water molecules (SOL). I would like to know that, do I have to use two
groups to control the temperature or just use one?

Can anyone help me?

Thank you.

A. G. G

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