AMBER Archive (2004)

Subject: Re: AMBER: Problem using GLYCAM with sander

From: David A. Case (case_at_scripps.edu)
Date: Fri Jan 23 2004 - 15:41:22 CST


On Fri, Jan 23, 2004, Itziar Maestre Asenjo wrote:
>
> I am trying to use Glycam for the study of carbohydrates.

> Found a non-zero 10-12 coefficient, but source was not compiled with
> -DHAS_10_12.
> If you are using a pre-1994 force field, you will need to re-compile
> with this flag.
>

The mail archives have repeated references to this problem. You must
compile with "-DHAS_10_12" in order to use the glycam force field.

..dac

-- 

================================================================== David A. Case | e-mail: case_at_scripps.edu Dept. of Molecular Biology, TPC15 | fax: +1-858-784-8896 The Scripps Research Institute | phone: +1-858-784-9768 10550 N. Torrey Pines Rd. | home page: La Jolla CA 92037 USA | http://www.scripps.edu/case ================================================================== ----------------------------------------------------------------------- The AMBER Mail Reflector To post, send mail to amber_at_scripps.edu To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu