On Wed, Apr 28, 2004, Jiten wrote:
>
> When I run the Gibbs, I got the following error
>
> %GIBBS-F-MISMATCH, The parm and coord files disagree on the number of atoms
>
> In amber reflector, somebody suggested to check the number of atoms in top and crd files.
>
> Here it is
>
> *.crd
>
> 22214
You need to manually remove the space in column 1 of the above line: gibbs
expects to read the number of atoms in an I5 format, not I6.
....regards...dac
--
==================================================================
David A. Case | e-mail: case.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
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Received on Wed Apr 28 2004 - 19:53:01 PDT