[gmx-users] How to build a topology file of Gromacs for a system contains two graphene sheet?

It depends whether you are simulating a flexible sheet or fixed wall. For flexible sheet you should define each sheet in one itp file. -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read

[gmx-users] How to build a topology file of Gromacs for a system contains two graphene sheet?

I want to create a topology. top file of gromacs package for a system containing two graphene sheet. Does anyone know how can I make that? Also, I have some questions as follows: 1- Is it need to assign [pair] directive for such system? 2- Are these two sheets should be considered as one compound a