AMBER Archive (2006)

Subject: AMBER: DRMS setting for Nmode calculation

From: Shuting Wei (
Date: Thu Dec 07 2006 - 14:46:54 CST

Dear All,

When i tried to use mm_pbsa for the binding energy calculation, i
have no idea about the DRMS value.

In the amber9/src/mm_pbsa/Examples/, DRMS = 0.0001, although NM=0

In the amber9/src/mm_pbsa/Examples/04_MMPBSA_Nmode/, DRMS =
0.1, this time NM=1

Which value should i use?



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