Re: [AMBER-Developers] Amber12 release candidate 2: rism hang

From: Scott Brozell <sbrozell.rci.rutgers.edu>
Date: Fri, 23 Mar 2012 16:28:26 -0400

Hi,

Yes it is already on the wiki, but i wanted to give a heads up
on the serial rism1d hang.

Note that control-c terminated testing but not rism1d:
11547 scott 20 0 68068 38m 2040 R 99.9 0.2 727:47.83 rism1d

If that first test, spc-kh, is commented out then there are no
more hangs. Everything passes except:

diffing spc-nacl-3.gvv_dT.save with spc-nacl-3.gvv_dT
possible FAILURE: check spc-nacl-3.gvv_dT.dif
==============================================================
if [ -n "testrism" ]; then cd ./rism1d/spc-hnc && ./Run.spc-lj; fi
 eunit 0
ERROR> reallocation_pointer deallocate error: 2D REAL 3
1
  ./Run.spc-lj: Program error


The dif is round off.
The error may be a big clue.

scott

On Fri, Mar 23, 2012 at 03:44:47PM -0400, David A Case wrote:
> On Fri, Mar 23, 2012, Scott Brozell wrote:
> >
> > Red Hat 6.1, Intel 12.1.0, No MKL, x86_64, Only AmberTools serial 3/22/12 SRB
> > Configure command: ./configure intel
> >
> > 486 file comparisons passed
> > 0 file comparisons failed
> > 0 tests experienced errors
>
> Probably better to post to the wiki; that way everything is in one place.
>

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Received on Fri Mar 23 2012 - 13:30:02 PDT
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