Re: [gmx-users] editying top file after solvation

2010-08-21 Thread Justin A. Lemkul
jojo J wrote: Dear gmx users, I am solvating a solute with a solvent molecule using command line below: genbox -cp solute.gro -cs solvent.gro -o solvated.gro -p solute.top solute is in a 20nm cubic box and by this command I am getting solvated box. solute.top is the top file of solute. I se

[gmx-users] editying top file after solvation

2010-08-21 Thread jojo J
Dear gmx users, I am solvating a solute with a solvent molecule using command line below: genbox -cp solute.gro -cs solvent.gro -o solvated.gro -p solute.top solute is in a 20nm cubic box and by this command I am getting solvated box. solute.top is the top file of solute. I searched the archive