[gmx-users] free energy problem
elham.tazikeh at gmail.com
Sun Oct 19 11:14:56 CEST 2014
thanks for your replys and your patient
i think my main problem is the way of using of perl/shell scripts in your
tutorial (Free energy for methane)
my question is: for script using, i must be execute them by *(chmod +x
...) * and then use of this command (*perl write_mdp.pl
<http://write_mdp.pl> em_steep.mdp * or
*sh write_sh.pl <http://write_sh.pl> em_steep.sh*) ? are they correct?
in this tutorial, its up to us that choose of *perl scripts *or *shell
scripts* without any difference?right??
at the end, script files read from mdp files without any changes or
rep0lacing by values by us...is it correct?
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