[gmx-users] energy units
Michal Kolinski
mkolin at iimcb.gov.pl
Tue Apr 19 15:45:53 CEST 2005
Hi all
In manual it says energy units are kj/mol. G_energy gives all the energies in kJ mol\S-1\N units:
@ title "Gromacs Energies"
@ xaxis label "Time (ps)"
@ yaxis label "E (kJ mol\S-1\N)"
My system is made of dppc lipid, protein, ligand and ions.
Is there any easy way to calculate all the energies using kj/mol units.
Thank you in advance.
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