[gmx-users] Pre-equilibrated CHARMM lipid bilayers

James Starlight jmsstarlight at gmail.com
Wed Dec 19 16:45:33 CET 2012

Hi Joakim!

MAny thanks for such big collection of the bilayers. Have your
simulated different protein embedded in that bilayers ? What force
field did you use for parametrisation of the proteins for such
simulations ? From the mdp file I noticed relatively big cutoffs for
vdw as well as electrostatics ( bigger than in charmm force fields).
Would it possible to simulate proteins parametrized by charmm in that
lipids ussing charmm parametres for whole system?

Thanks again,


2012/12/19 Joakim Jämbeck <jambeck at me.com>:
> Joakim

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