[gmx-users] Own Coarse Grained ff

2012-11-20 Thread Steven Neumann
Dear Gmx Users, I want to simulate protein based on my own LJ parameters between different types of residues. I will be given sets of parametrs for given sizes of beads to then apply them and valide by atomistic simulations. My question: 1. What is the best way to build different sizes of beads

Re: [gmx-users] Own Coarse Grained ff

2012-11-20 Thread Justin Lemkul
On 11/20/12 9:02 AM, Steven Neumann wrote: Dear Gmx Users, I want to simulate protein based on my own LJ parameters between different types of residues. I will be given sets of parametrs for given sizes of beads to then apply them and valide by atomistic simulations. My question: 1. What is