Dear AMBER community,
Just a quick question.
It it possible to specify different restraint weights for different parts of a protein?
There is no complaint from sander for an input something like
--------------------------------------------
ntr=1, restraint_wt=10.0, restraint_mask=':1-10',
restraint_wt=1.0 , restraint_mask=':11-20'
--------------------------------------------
but, it appears that only the last restraint was accepted.
A search in the archive gave a similar question, but there was no reply there.
Many thanks in advance,
Takanori
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Received on Wed Jul 05 2006 - 06:07:12 PDT
