AMBER Archive (2009)

Subject: Re: [AMBER] error in antechamber

From: Qinghua Liao (fantasticqhl_at_yahoo.com)
Date: Tue Jul 28 2009 - 00:13:49 CDT

Dear Prof. Case,

Thanks for your suggestion! And I am trying to figure it out. If I still have problem, I will consult you! Thanks!

All the best!

Qinghua

________________________________
From: case <case_at_biomaps.rutgers.edu>
To: AMBER Mailing List <amber_at_ambermd.org>
Sent: Tuesday, July 28, 2009 12:23:54 PM
Subject: Re: [AMBER] error in antechamber

On Mon, Jul 27, 2009, Qinghua Liao wrote:
>  
>  
>  Running: /usr/local/amber10/bin/mopac.sh
> Error: unable to find mopac charges in mopac.out

Look at the mopac.out file and see if you can find something relevant.  Of
course, there may not *be* a mopac.out file if the mopac program wasn't found.

>
> I can't understand that because I could run antechamber correctly a few
> days ago. I don't know what's the problem. Could you figure it out for
> me? Thanks in advance!

That's a pretty tall order for remote diagnostics.  It's pretty much a given
that no one on the list will know what changed on your computer during the
past few days.  You'll have to do some debugging yourself on this one.

....dac

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