VMD-L Mailing List
From: Chang, Christopher (Christopher_Chang_at_nrel.gov)
Date: Wed Nov 16 2005 - 13:11:30 CST
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Hi,
I am extracting an atom selection from very large DCD files, and
would like to script something that will use a loop to read a frame,
then append the atomselection to a new DCD file to lower memory demands.
Can "animate write" do this? Right now the command
animate write dcd outname.dcd beg $a end $a waitfor all sel $selection
top
in the loop with counter "a" and atomselection "$selection" overwrites
each (a-1)th structure with the (a)th one.
Thanks,
Chris
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