Bugs item #2899919, was opened at 2009-11-18 16:46
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Category: Commands / Extensions
Group: v 1.0.0
Status: Open
Resolution: None
Priority: 5
Private: No
Submitted By: https://www.google.com/accounts ()
Assigned to: Nobody/Anonymous (nobody)
Summary: allene minimizing flat MMFF94 implementation?
Initial Comment:
I think MMFF94 has parameters for cumulene carbons. However, allene is showing up flat after minimization. Is this an MMFF94 problem or implementation?
Thanks!
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