Dear AMBER community:
I have a very long, complicated list of residues that
I would like to restrain using ntr=1 during
minimization. There is no way that I can define this
list of residues in 80 characters or less, as is
required for the restraintmask variable. Has anyone
else faced a similar problem, and found a work-around?
For example, could I define a long list of residues in
a separate file and then have the restraintmask
variable read in that file? I would be very grateful
for any suggestions.
Thank you in advance.
Tanya
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Received on Wed Aug 02 2006 - 06:07:14 PDT
