On 8/06/2012 11:05 PM, Inon Sharony wrote:

Good afternoon!

I'm getting the following error message from mdrun, and despite trying, I can't seem to find the file futil.c in which the error is supposed to be taking place. Can anyone help me out, please?


It's the source file of GROMACS that produce the code from which the error originated.

Thanks, and have a good weekend!

Inon.


                         :-)  G  R  O  M  A  C  S  (-:


              GROningen Mixture of Alchemy and Childrens' Stories

                            :-)  VERSION 4.5.4  (-:

        Written by Emile Apol, Rossen Apostolov, Herman J.C. Berendsen,
      Aldert van Buuren, Pär Bjelkmar, Rudi van Drunen, Anton Feenstra,
        Gerrit Groenhof, Peter Kasson, Per Larsson, Pieter Meulenhoff,
           Teemu Murtola, Szilard Pall, Sander Pronk, Roland Schulz,
                Michael Shirts, Alfons Sijbers, Peter Tieleman,

               Berk Hess, David van der Spoel, and Erik Lindahl.

       Copyright (c) 1991-2000, University of Groningen, The Netherlands.
            Copyright (c) 2001-2010, The GROMACS development team at
        Uppsala University & The Royal Institute of Technology, Sweden.
            check out http://www.gromacs.org for more information.

         This program is free software; you can redistribute it and/or
          modify it under the terms of the GNU General Public License
         as published by the Free Software Foundation; either version 2
             of the License, or (at your option) any later version.

                      :-)  mdrun_d (double precision)  (-:


-------------------------------------------------------
Program mdrun_d, VERSION 4.5.4
Source code file: futil.c, line: 459

File input/output error:
md.log
For more information and tips for troubleshooting, please check the GROMACS
website at http://www.gromacs.org/Documentation/Errors
-------------------------------------------------------


mdrun can't do whatever it should be doing with this file. Probably you lack permissions or file space.

Mark
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