Dear Amber User:
I want run the pure QM (like PM3) molecular dynamics using Amber package. I
am wondering whether I can print out the dipole moment using &dipoles.
I fail to do it when I try to use it. Any suggestions would be greatly
appreciated.
--
Best Wishes
Sincerely Yours
Hong-bin Xie
---------------------------------------------------------------
Hong-bin Xie
Postdoctoral Researcher
Department of Chemistry
University of California at Irvine
Email:xhbxhb1980224.gmail.com <Email%3Axhbxhb1980224.gmail.com>
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Received on Fri Aug 20 2010 - 15:00:03 PDT