Greetings AMBER friends,
I am interested in dynamic-ensemble refinement as described by in the following article:
http://www.nature.com/nature/journal/v433/n7022/full/nature03199.html
The authors use CHARM. I would prefer to use AMBER. Does AMBER have the functionality to generate NMR derived order parameter restraints for use in refinement? I do not see this explicitly stated in the AMBER 12 Manual, but am curious if there is a work around or if this feature is under development.
KB
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Received on Wed Dec 05 2012 - 09:00:02 PST
