Re: [AMBER] MMPSA: PB Bomb in pb_aaradi(): ...

From: Jason Swails <>
Date: Tue, 7 Aug 2012 10:49:29 -0400

On Tue, Aug 7, 2012 at 10:32 AM, Vlad Cojocaru <> wrote:

> No Jason, I don't get this warning because I get the error and the
> program crashes beforehand ...

But that warning should be emitted before the aaradi subroutine is called
(since that's where radiopt is overwritten with inp=2). But perhaps I'm
missing something, since I'm not an expert with the PBSA code.

All the best,

Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Candidate
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Received on Tue Aug 07 2012 - 08:00:04 PDT
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