Re: AMBER: Fwd: antechamber save prmtop inpcrd

From: David A. Case <case.scripps.edu>
Date: Wed, 4 Jul 2007 08:53:04 -0700

On Tue, Jul 03, 2007, Francesco Pietra wrote:

> Warning "not saved" on quitting xleap after having run
>
> saveamberparm ...
>
> is typical behavior of xleap

I don't think this is correct. If the actual statement is "Parameter file was
not saved", that means just what it says. There should always be error
messages preceeding this that indicate the problem (usually missing
parameters).

You might want to compare your results with the leap.out.save script
in $AMBERHOME/test/antechamber/sustiva, for example.

...dac

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Received on Sun Jul 08 2007 - 06:07:11 PDT
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