Tatsiana Kirys wrote:
Hi,
i got strange results using g_rms.
Does it by default uses mass weighting for superposition?
I wrote my own script to calculate rmsd without mass weighting and it gives different results then using g_rms.
If it uses mass weighting for superposition how not not use it? i tried select "-mw no", but it doesn't work.
As always, g_rms -h explains some relevant issues here.
Also, "it doesn't work" is also a useless description for helping us
help you. :-)
Mark
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