subject:"\[gmx\-users\] zero SOL molecules"

Re: [gmx-users] zero SOL molecules

2011-03-06 Thread Justin A. Lemkul

sarah k wrote: Dear all, I am adding Nitrogen box instead of water molecules to my protein. Based on your guidelines I generated the coordination and topology file of nitrogen. Then I used the following command: genbox -cp A_newbox -ci -42000mol N2C.gro -o A_solv.gro -p topol.top N2C.gro

[gmx-users] zero SOL molecules

2011-03-06 Thread sarah k

Dear all, I am adding Nitrogen box instead of water molecules to my protein. Based on your guidelines I generated the coordination and topology file of nitrogen. Then I used the following command: genbox -cp A_newbox -ci -42000mol N2C.gro -o A_solv.gro -p topol.top N2C.gro is my new file made man