[gmx-users] restraining the ligand.

ibi2010004 at iiita.ac.in ibi2010004 at iiita.ac.in
Sat Nov 19 17:57:15 CET 2011


Hello gmx_users,

I have a query.I generated my ligand topology from swissparam using charmm
forcefields.Later in the tutorial after minimization step,You have
mentioned of program genrestr to restrain the ligand.

Is it applicable to all other methods that are not following prodrg
software.If not,then we have to change it directly in topology file?

Thanx.


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