[chimera-dev] minimizer

Elisabeth Ortega eortega at klingon.uab.es
Wed Mar 16 14:46:42 PDT 2011


Dear Chimera Dev. Team,


I have a question about the Minimizer. I want to use it in the Python/IDLE
to calculate the initial energy of a system during the execution of one of
my scripts,
but I don't found any way to call the function Minimizer and obtain the
numeric result without show the addCharge window if I have a metallic
system.

What can I do to call this function correctly?


Thank You

Elisabeth Ortega
Universitat Autònoma de Barcelona
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