Re: [AMBER] where to check output restraint-wt (ntr=1) decleared with restraintmask

From: case <case.biomaps.rutgers.edu>
Date: Fri, 26 Nov 2010 08:38:55 -0500

On Fri, Nov 26, 2010, xueqin pang wrote:
>
> Thanks for reply. Actually I searched both restraint and
> 10 (which is my restraint_wt), but find nothing, that is why I
> ask. Attached is the out put, can you check it for me.

You are correct: this will be fixed in the next release. You can modify
$AMBERHOME/src/sander/mdread.f to print the value if you wish.

...dac


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Received on Fri Nov 26 2010 - 06:00:07 PST
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