[gmx-users] CMAP and Free Energy

francesco oteri francesco.oteri at gmail.com
Wed Feb 27 12:08:47 CET 2013


Dear gromacs users,
can someone of you explain me why CMAP is not managed in  Free Energy?
I guess that the force derived by CMAP can be traited as any other force.
Is there any theoretical problem in doing:
CMAP(lambda) = (lambda)*CMAP +(1-lambda)*CMAP
?

Francesco



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