[gmx-users] POPC membrane simulations
chris.neale at utoronto.ca
Fri Mar 23 00:27:31 CET 2007
If I understand correctly you want to construct popc.itp from the
dppc.itp that is available on Tieleman's site? And you have used PRODRG
to do this? That sounds like a lot of extra work when popc.itp is
directly available from Tieleman's site...
The fact that you want to use ffG53a5 and not ffgmx is more of an issue.
To do that you need to avoid lipid.itp and do something like this:
However, you will want to heed this warning (or at least understand it):
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