On Mon, Oct 02, 2017, Alessandro Mariani wrote:
> Now i really do not understand why that "mol" is there.
> And, maybe, explain to me why to not use SI units in Amber?
Using SI would not help any here. To convert from kcal/mol to kcal, divide by
Avogadro's number. To convert kJ/mol to kJ, do the same thing.
....dac
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Received on Mon Oct 02 2017 - 07:00:02 PDT