RE: AMBER: Algorithm for integration of equations of motion

From: Ross Walker <>
Date: Wed, 20 Jun 2007 12:38:36 -0700

Hi Roberto,
Amber uses the Leap Frog algorithm for integration. See Leach "Molecular
Modelling: Principles and Applications" or other similar text books.

|\oss Walker

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From: [] On Behalf Of
Roberto Veiga
Sent: Wednesday, June 20, 2007 11:56
Subject: AMBER: Algorithm for integration of equations of motion

Hi all:

I need an information to put in my thesis (I used Amber to carry out the
calculations): which is the algorithm used to integrate the equations of



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Received on Sun Jun 24 2007 - 06:07:14 PDT
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