Re: [gmx-users] Restrain specific lipid residues

That's a simple enough way to deal with it - thanks! On Sep 25, 2012, at 2:16 PM, Justin Lemkul wrote: > > > On 9/25/12 5:14 PM, Katrina Lexa wrote: >> Hi everyone, >> >> This is probably a very silly question, but if I want to restrain only >> certain

[gmx-users] Restrain specific lipid residues

Hi everyone, This is probably a very silly question, but if I want to restrain only certain lipid residues in my bilayer, based on their residue number, is there some other way to do this aside from just having an explicit residue-by-residue list of them & their topologies in my .top? I'm just

[gmx-users] help with "interaction of type atom in the topology database, but an atom of that name was not found in residue" error

Hello Gromacs Users: I apologize for asking a question that has come up several times in the forum, but I have read the answers to those posts and I am not still unable to fix the error based on the suggestions in the previous emails. It is completely possible that I am just not seei