[AMBER] chemical shift penalty

From: Jacopo Sgrignani <sgrignani.cerm.unifi.it>
Date: Thu, 5 Mar 2009 10:47:03 +0100 (CET)

i would like to perform a simulation using chemical shift based penalties.
I found that Amber can do that, but i would like to get tecnical notes
about the matematical form of the penalty function and how the chemical
shifts are used.
Can anybody help me to find references?

Thanks a lot


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Received on Fri Mar 06 2009 - 01:20:08 PST
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