Hi to all
I used this script to calculate the Bfactor.The temprature factor variation
was quite large (20-400).I want to know what is the unit of Bfactor in this
case and the values I am getting is that right if the units is Angstrom.
trajin complex_equi.mdcrd
center origin
reference complex_wat.crd
atomicfluct out bfac.dat byres .CA bfactor
Thanks
Shandilya Ashutosh
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Received on Mon Sep 13 2010 - 23:00:03 PDT
