Re: [AMBER] error with CPPTRAj

From: Mohammad Salem <mohammad.alaraby.gmail.com>
Date: Fri, 16 Aug 2019 13:25:01 +0200

Thanks I figured out there were corrupt frames. I am not sure why though (a gap in the middle, then good frames in the end)
> On Aug 16, 2019, at 12:44 PM, Mohammad Salem <mohammad.alaraby.gmail.com> wrote:
>
> Hi All,
>
> I am trying to run an RMSD calculation with CPPTRAJ. I get this error.
>
> Error: NetCDF spatial variables are '', '', '', not 'x', 'y', 'z'
> Error: Could not set up '../prod1.nc' for reading.
>
> The previous steps (heating and density eq) worked fine. The only difference is that I ran the production on GPU.
>
> Any insights?
>
> Regards,
>
> M. Salem


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Received on Fri Aug 16 2019 - 05:00:02 PDT
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