[gmx-users] Regarding Minimization

[Ravi Kumar Venkatraman]

*Dear all,**
*
*            I wanted to minimize the energy of a single molecule. How
emtol and emsteps I have to put to get optimised single molecule structure.*
*
*
*Thank you**
*
*
*
*With Regards,
Ravi Kumar Venkatraman,
IPC Dept., IISc,
Bangalore, INDIA.

+91-9686933963.*
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