[AMBER] Bug in ptraj (Ambertools 13 patch 20)

From: Åke Sandgren <ake.sandgren.hpc2n.umu.se>
Date: Mon, 18 Nov 2013 18:08:23 +0100

Hi!

One of our users tripped on a bug in ptraj.
Using a fairly large problem that needs >223GB of memory.

Attached patches.

Also fixed one case of uninitialized variable. 

-- 
Ake Sandgren, HPC2N, Umea University, S-90187 Umea, Sweden
Internet: ake.hpc2n.umu.se   Phone: +46 90 7866134 Fax: +46 90 7866126
Mobile: +46 70 7716134 WWW: http://www.hpc2n.umu.se

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Received on Mon Nov 18 2013 - 09:30:03 PST
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