Qian Wang wrote:
Hi,
I used umbrella sampling method to restrain the distance of two molecules at several distances. Then I can use g_wham to get the free energy as a function of the distance. Is there any way that I can get the free energy as a function of another parameter? Thanks a lot.

Please define what the other parameter is. Right now the only answer is "maybe, maybe not."

-Justin

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========================================

Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

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