Hi Taufik,
> Hold the DNA fixed
> 100.0
> RES 1 40
> Hold the protein fixed
> 100.0
> RES 41 154
> END
> END'
>
> rfree: Error decoding variable 2 2 from:
> Hold the
I believe that you need this all on 1 line so:
Hold the DNA fixed
100.0
RES 1 40 41 154
END
END
Although you might be better off using the restraint_mask syntax which would
be, I think, ':1-40,41-154' or you could just write this as ':1-154' I
assume...
Note 100.0 is probably too large a restraint for actual MD - you should
probably reduce this to 10.0 or less.
All the best
Ross
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|\oss Walker
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Received on Wed Oct 22 2008 - 05:10:59 PDT
