[gmx-users] About the GROMOS96 parameters files
stephane.abel at cea.fr
Mon Oct 3 10:34:05 CEST 2011
I would like to reproduce the results obtained in the paper of Marrink et al
"Molecular dynamics simulations of the kinetics of spontaneous micelle
formation". J. Phys. Chem. B, 104:12165-12173, 2000". In this (old but
interesting) work, the authors used the GROMOS96 force field to model the
DPC lipid. I have found the topology file for the lipid in the P. Tieleman's
website but not the GROMOS96 lipid parameters. I have contacted one of the
authors (SJ Marrink), but unfortunately, he has not kept the files.
Does anyone know where I can find this file in the GROMACS format?
I have also found a "ffgmx_lipids.tar.gz" file in the "user contribution"
section of the GROMACS's website. Is this file is the GROMOS96 parameter for
lipids used in this paper above?
Thanks in advance for your response.
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