Re: [AMBER] error

From: David A Case <>
Date: Tue, 10 Dec 2019 07:46:18 -0500

On Tue, Dec 10, 2019, MYRIAN TORRES RICO wrote:
>I have a problem with my MD-tar. I have launched the scritps and I
>have obtained this error:

Here's one problem: we don't know what you mean by "MD-tar", or "the
scripts". So we can't really help very much.
>ERROR: NetCDF restart has Conventions that are not AMBERRESTART.
>ERROR: Could not read second line of ./vcte/smp-195-ptn4rig_vcon3.mdcrd

Try this: 'file ./vcte/smp-195-ptn4rig_vcon3.mdcrd': does is say "data"
or something like "ascii text"? Also, the "mdcrd" extension is usually
used for trajectory files, not restart files. Is it possible that you
fed some program a trajectory file instead of a restart file?


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Received on Tue Dec 10 2019 - 05:00:02 PST
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