Hi!
I have the coordinate file (.gro) of a Gromacs simulation box (i.e. protein solvated in water).
Can I convert this file into something that can be used as input for molecular dynamics simulation in Amber?
Regards,
Adam
ps. I have simulated the system in Gromacs for ~ 100 ns, and wish to continue the same simulation in Amber
pps. The simulation in Gromacs uses an Amber force-field. So blow-ups are unlikely.
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Wed Mar 21 2012 - 10:30:02 PDT
