Re: [AMBER] safemem.o error while compiling Ambertools 1.5

From: Josmar R. da Rocha <bije_br.yahoo.com.br>
Date: Thu, 13 Oct 2011 20:34:22 -0700 (PDT)

Hi Tyler,

That solved the problem and I got AT1.5 installed. Thank you very much for your help!

--- Em qui, 13/10/11, Tyler Luchko <tluchko.rci.rutgers.edu> escreveu:

De: Tyler Luchko <tluchko.rci.rutgers.edu>
Assunto: Re: [AMBER] safemem.o error while compiling Ambertools 1.5
Para: "AMBER Mailing List" <amber.ambermd.org>
Data: Quinta-feira, 13 de Outubro de 2011, 21:05



On 10/13/2011 06:35 PM, Josmar R. da Rocha wrote:
> Dear amber users,
> I got an error when I tried to compile the AmberTools 1.5 in a server with 24 GB ECC RAM and two Tesla C2070, after having patched it with the bugfix.all.
>
> make[1]: Entering directory `/usr/local/amber11/AmberTools/src/rism'
> cpp -traditional -P  -DBINTRAJ    -DRISM -DRISM_CRDINTERP -DRISM_DX
> -DRISM_LINPROJ  rism_report_c.f>  _rism_report_c.f
> gfortran -c -O3 -mtune=generic -ffree-form   -o rism_report_c.o _rism_report_c.f
> cpp -traditional -P  -DBINTRAJ    -DRISM -DRISM_CRDINTERP -DRISM_DX
> -DRISM_LINPROJ  safemem.f>  _safemem.f
> gfortran -c -O3 -mtune=generic -ffree-form   -o safemem.o _safemem.f
> _safemem.f:105.40:
>
>      type(memTracker),private :: totalMem
>                                          1
> Error: Object 'totalmem' at (1) must have the SAVE attribute for
> default initialization of a component
> make[1]: *** [safemem.o] Error 1
> make[1]: Leaving directory `/usr/local/amber11/AmberTools/src/rism'
> make: *** [serial] Error 2
>
> The gcc version is 4.4.4 20100503 (Red Hat 4.4.4-2) running in Fedora 13 x86_64.
> In the second server, that has 8 GB ECC RAM, the previous version of
> AmberTools (AT-1.4) was installed. I renamed the folder and so tried
> to install the new version and so the same error was appears. I think
> the problem is due to ECC memory, because we have workstations with
> Non-ECC memory and the AmberTools-1.5 + Amber11 were compilled without
> any problem.
> Do you have any guess on how can I solve it?
>

Hi Josmar,

I'm not sure why you are getting a compile error here but as a quick
fix. Try changing the offending line in safemem.f (not _safemem.f) to read

type(memTracker),private,save :: totalMem

Testing this locally, it doesn't change output at all. Worst case
scenario, memory usage reports by RISM will be incorrect.

I will check into the source of this error but I doubt this has anything
to do with hardware.

Hope this helps,

Tyler

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Received on Thu Oct 13 2011 - 21:00:02 PDT
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