[gmx-users] Molecule which is not defined in the rtp file

Justin A. Lemkul jalemkul at vt.edu
Sat Jul 12 12:26:20 CEST 2008

prasun kumar wrote:
> If the molecule is not defined in the forcefield.rtp file then how can i 
> get the itp file(at that time pdb2gmx will not work).In that case what 
> should I do?
> THanx a lot for your suggestions

You read my previous message about how to create an .itp file.


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Justin A. Lemkul
Graduate Research Assistant
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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