Re: [AMBER] chamber

From: Mark Williamson <mjw.mjw.name>
Date: Thu, 03 Mar 2011 09:53:24 +0000

colvin wrote:
> Hi,
>
> nope, it didn't solve the problem. However, in CHARMM-GUI, they have other
> options of ion, so i change it to NaCl and now chamber can read and write
> out amber prmtop & inpcrd.
>
> Thanks and regards,
> Colvin

Hi Colvin,

Perhaps you could send me all your input files (offlist to mjw.mjw.name)
and I could use them to see why the code is failing, and, hopefully,
generate a patch to fix this if there is an issue with the code.

Regards,

Mark

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Received on Thu Mar 03 2011 - 02:00:02 PST
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