AMBER Archive (2009)

Subject: RE: [AMBER] Solved-Amber 1.2 tools test suite failure

From: Ross Walker (ross_at_rosswalker.co.uk)
Date: Sat Apr 11 2009 - 14:51:13 CDT

Hi Jim

>antechamber/tp/Run.tp
>
>Original error was
> >make -f Makefile_at test
...
...
>cd antechamber/tp && ./Run.tp
> ./Run.tp: Program error
>make: *** [test.antechamber.hasG77] Error 1

>I traced the failure back to the mopac.sh script
...
...
>ln mopac.in FOR005
>/home/surfer/tmp/amber10/bin/mopac >& FOR006
>mv FOR006 mopac.out
>rm -f FOR0??

This has been discussed before it would appear:

http://archive.ambermd.org/200809/0148.html

It looks like this never actually made it to a bugfix for ambertools 1.2
though. I will put one together and post it on the website.

All the best
Ross

/\
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|\oss Walker

| Assistant Research Professor |
| San Diego Supercomputer Center |
| Tel: +1 858 822 0854 | EMail:- ross_at_rosswalker.co.uk |
| http://www.rosswalker.co.uk | PGP Key available on request |

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