[gmx-users] question

Golnaz Roudsari golnaz.chem at gmail.com
Fri May 15 16:16:56 CEST 2015


Dear gmx-user
I want to simulate graphene and surfactants in water. In most of the paper
they put surfactants perpendicular on the graphene sheet. I have problem in
initial configuration. I do not know how They put them perpendicular on the
graphene sheet. I can not put them random in my box because I do not have a
perfect system for more than 50 ns MD run.
Thank you in advance
Golnaz Vahabpour


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