Re: [gmx-users] Gromacs 96 and POPE

2007-02-06 Thread Steffen Wolf
Hu Ugur, actually you don't have to care to run the lipid pdb by Tieleman through pdb2gmx at all - just copy the respective lines out of lipid.itp into ffG43a1bon.itp and ffG43a1nb.itp (or the force field you want to use) and put "#include pope.itp" into your *.top file - et voila, you're done. Att

[gmx-users] Gromacs 96 and POPE

2007-02-05 Thread Ugur Akgun
Hi all; I am new to Gromacs, trying to create a membrane with POPE lipids. I got the pope.itp and lipid.itp (for Gromos87) files from Tieleman group web site, and trying to make POPE recognized by pdb2gmx. So far I could not get it done.. - Can it be because lipid.itp is not for Gromos96? do