Thanks. When correctly run
$ make test.serial
does indeed generate a TEST_FAILURES.diff, related to amoeba, QM-MD, and
antechamber. The latter module will be my horse.
I tried to understand the failures displayed. Cryptic for me at this stage.
Therefore, I regret to have to ask for help again. Though, I understand, I am
on the right road.
Thanks
francesco
--- "David A. Case" <case.scripps.edu> wrote:
> On Sat, Jun 30, 2007, Francesco Pietra wrote:
>
> > $ make test serial
>
> This should be "make test.serial". A summary of failures (if any) is
> maintained in TEST_FAILURES.diff. Since elsize is the last test, you are
> probably fine.
>
> If you are new to Amber, I strongly recommend you just use the serial codes
> for a while, gaining some experience. There is generally no need for
> parallel
> codes until you have big jobs, and until you are convinced that you will be
> able to run and analyze them correctly. Almost everyone finds that running
> biomolecular simulation tools takes some learning.
>
> ...dac
>
> -----------------------------------------------------------------------
> The AMBER Mail Reflector
> To post, send mail to amber.scripps.edu
> To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
>
____________________________________________________________________________________
Get the free Yahoo! toolbar and rest assured with the added security of spyware protection.
http://new.toolbar.yahoo.com/toolbar/features/norton/index.php
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Sun Jul 01 2007 - 06:07:52 PDT
