[gmx-users] conserved energy

Ahmet Yıldırım ahmedo047 at gmail.com
Fri May 22 17:56:06 CEST 2015

Dear users,

The total energy obtained from the .edr file is the sum of potential and
kinetic energy of system. But there is not any information about conserved
energy in manual. Maybe I couldn't find it.
I am looking for answers of the following questions:
-Which energy contributions/terms does the conserved energy include?
-How I get individual contributions (like constrains' contribution) to the
conserved energy?

Any help will be appreciated.

Ahmet Yıldırım

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