On Wed, May 25, 2011, JORGE IULEK wrote:
>
> I recently noved to a new laptop (where I calculate energies after
> cluster productive runs). In my former laptop, I had openSuSE 11.2 (64
> bits), to which I compiled AmberTools 1.3 and Amber10, gcc version 4.4(.1 as
> reported by configure)-4.2, all patches applied, following instructions at
> http://archive.ambermd.org/201001/0150.html, and things ran as expected. To
> my new laptop, I went to openSuSE 11.4 (64 bits), gcc is 4.5(.1 as reported
> by configure)-19.1 (as reported by yast2). AmberTools compilation seems to
> go fine, but at "test" I get the error:
As a workaround, edit the $AMBERHOME/test/nab/Makefile to skip the duplex
test. See if anything else is broken.
Otherwise, download AmberTools 1.5 into an amber11 tree, and set your AMBERHOME
variable to that location. You can use that version of NAB (and other amber
tools), and continue to use the sander or pmemd programs from the Amber10
directory tree.
...good luck...dac
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Received on Wed May 25 2011 - 08:30:02 PDT
