Hi Dr. Case,
Thanks a lot for your replies. I'm really glad that it looks like I can
trust the analyses that I've done so far with ptraj/tleap/ambpdb! Thanks
also for the advice about upgrading to AmberToolsv1.5; I hadn't realized
that it was out.
I've posted the config.h file from /usr/local/amber11/AmberTools/src/;
please let me know if it would be helpful to also post the config.h file
from /usr/local/amber11/src/.
What I meant when I said that I had begun by running the tests by hand was
that I went into each directory within /usr/local/amber11/AmberTools/test/,
and ran all the Run.* scripts in each of these directories by hand.
Thank you all again for all your help, and have a great day,
Kamali Sripathi
On Mon, May 9, 2011 at 3:38 PM, David A Case <case.biomaps.rutgers.edu>wrote:
> On Mon, May 09, 2011, David A Case wrote:
>
> > what version of AmberTools are you using?
>
> Sorry...I see from the subject line that you are talking about
> AmberTools1.4.
> If you are just getting started, upgrading to version 1.5 might make good
> sense....lots of problems have been squashed in the past year.
>
> ...dac
>
>
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>
--
Kamali Sripathi
Graduate Student, Medicinal Chemistry
Walter Laboratory
930 North University
Ann Arbor, MI, 48109
ksripath.umich.edu
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Received on Tue May 10 2011 - 05:30:03 PDT
