NAMD Internal energy unit

From: Norman Geist (
Date: Wed Oct 23 2013 - 05:16:57 CDT

Hi experts,


I'm currently adapting some of the replica.namd TCL code. I noticed, that
the energies got through save_array output different values before and after
outputenergies took effect. Could it be that namd stores these values in a
different unit and when that the energies get transformed before printed to
the log? What's the exact factor here?




Norman Geist

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