[gmx-users] Temperature Calculation in MD

Ray Chao xiaoainisa at gmail.com
Sat Feb 20 21:58:57 CET 2016

Hi, Justin,

Thanks for your response. By extracting temperature information out edr
file, do you mean the "gmx enemat" command?  Actually what I was up to is
calculate the temperature development of a certain region instead of a
group of atoms.

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