I am trying to create a frcmod file to generate dummy atom parameters via the procedures in this tutorial
http://ambermd.org/tutorial/shirts/
Is there a command to list all the gaff parameters in the frcmod file or is there a simpler alternative method to generate dummy atoms? My molecule is larger and more complex than toluene.
Thanks in advance for your help.
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Received on Wed May 20 2009 - 15:07:29 PDT
