[AMBER] sander simulated annealing

From: Charles Johnson <cjohns98.slu.edu>
Date: Wed, 2 Nov 2011 10:53:50 -0500

I am currently trying to run simulated annealing in vacuum and am running into the following error:

At line 976 of file _nmrcal.f
Fortran runtime error: Bad data for namelist object rk2

Any help would be greatly appreciated.

Thanks,
Charlie

-- 
Charles A. Johnson
Graduate Student
Department of Chemistry
Saint Louis University
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Received on Wed Nov 02 2011 - 09:00:04 PDT