[gmx-users] temperature..
Mark Abraham
Mark.Abraham at anu.edu.au
Wed Jun 20 16:24:14 CEST 2007
abhishek sharma wrote:
> dear all,
> i completed a simulation of copper nanoparticles.I want to observe the
> change in temp during the simulation.could u please help me in
> calculating the temperature of the system at the end of simulation.
Very funny. This is the same type of question you asked on June 17, to
which I replied here -
http://www.gromacs.org/pipermail/gmx-users/2007-June/028053.html My
reply is the same... read section 7.4 of the manual and *work out* which
utility might be useful for you. You might even remember some of the
other ones so that next time you don't have to search as hard.
If you ever want to be any good in this field, you will have to work out
how to read and learn independently. This is what a university degree
should be teaching people. This email list is not a free consultancy
service for asking simple questions that are easily covered in the
manuals and tutorials. Our time is valuable, and you should respect that
if you want some of it.
Mark
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