[gmx-users] charge atoms

cesteban at unsl.edu.ar cesteban at unsl.edu.ar
Tue Sep 2 20:34:18 CEST 2008


Hi All
I am trying to analyze the dynamics of polymer of GlcN residues using
ffG53a6 force field.
I made a new building block in .rtp file, but I haven´t the charge of some
atoms.
Which is the best procedure to obtein new charges?
Someone has experience about this?
Any help would be appreciated
Carmen




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