AMBER: terms in mm-pbsa

From: Lwin, ThuZar <ThuZar.Lwin.stjude.org>
Date: Wed, 21 Jun 2006 10:48:37 -0500

Hello Amber Community,

     I would like to clarification on the difference between the two
terms found in mm_pbsa.in to calculate the stability free energy:

PRBRAD used in PB and PROBE used in MS (my selections are PROC=1 and
MS=1). Is PRBRAD the one being passed onto molsurf ?

 

Thanks,

ThuZar

 

       



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Received on Sun Jun 25 2006 - 06:07:07 PDT
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