[gmx-users] Force field parameterization for PAMAM dendrimers

faride badalkhani farideh.khamseh at gmail.com
Mon May 18 09:28:40 CEST 2015


Dear all,

I want to perform MD simuations on PAMAM dendrimers, but unfortunately this
molecule has not been defined in any of the GROMACS force fields.
Therefore, I should parameterize the force field for my purpose. How should
I do this procedure?
(It is mentionable that I read the
http://www.gromacs.org/Documentation/How-tos/Parameterization
but I could not perform any runs!)

Truly yours,
Farideh


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