Hello
Concerning improper dihedrals to preserve chirality.
If I am using improper dihedrals in this way, then the atoms that make the angle are not necessarily bonded.
I have read that LEaP will assign them based on the basis of the atoms being bonded to one another.
Is there a way around this?
Thanks
Cody
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Received on Tue Apr 30 2013 - 13:30:03 PDT