Dr. Case
I ran the job in serial sander.
I was not using any other program while seeing this message. In fact, while it was running, it appeared in the terminal. So I was wondering what it was all about.
Bill,
how can I get further clues by looking each term individually? I would appreciate if you please explain it a bit so I would better analyze the results?
Thanks
Ramin
________________________________
From: David Case <david.case.rutgers.edu>
Sent: Thursday, June 15, 2017 10:01:43 AM
To: AMBER Mailing List
Subject: Re: [AMBER] Warning during minimization
On Thu, Jun 15, 2017, Ramin Salimi wrote:
>
> WARNING **: No offset found for match "n" at page 421 after processing 1
> results
Wow...I've never seen this message before, and can't (easily) find the
corresponding code. Are you sure that this message comes from Amber (and,
say, not from some other process)? Which program are you using? If this
is a parallel job, does the behavior change with a serial run? (Or, is
this a GPU job)?
....thx...dac
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Received on Thu Jun 15 2017 - 21:30:02 PDT
