Hi all!
I’m using charmm-gui to solvate a protein and run the simulations using Amber. However, it seems like that the only water model available on charm-gui is TIP3P. I was wondering if there is a way to convert the water molecules of a *.parm7 file to another water model such as OPC or TIP4P?
Would appreciate your help,
Danial P.Dehkordi
Institute of Theoretical Biophysics - Molecular Dynamics <
https://www.t38.ph.tum.de/index.php?id=5>
Physic Department <
http://www.ph.tum.de/>
Technical University of Munich
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Tue Jun 12 2018 - 09:00:03 PDT
