Dear All,
I have a general question regarding the parameters used in the source
code. This is regarding AMBER9 source code. In mix_frcti subroutine, there
are some parameters defined, such as ecopy and ener. How can I check out
the source code to understand what they are corresponding to? I am trying
to understand how sander is working, starting from the input file, and I
am getting confused all the time. In some place of the program, ecopy and
ener arrays are calculated, but I cant find it. Thanks in advance.
Best,
--
Ilyas Yildirim
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= Department of Chemistry - =
= University of Rochester - =
= Rochester, NY 14627-0216 - Ph.:(585) 275 67 66 (Office) =
= http://www.pas.rochester.edu/~yildirim/ =
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Received on Sun Dec 16 2007 - 06:07:23 PST
