AMBER Archive (2006)

Subject: Re: AMBER: Can we use the distance restraint in Replica-exchange simulation with AMBER8

From: Carlos Simmerling (carlos_at_csb.sunysb.edu)
Date: Thu Nov 02 2006 - 14:28:33 CST

yes you can combine these two.

wenfei Li wrote:

> Dear Amber Users,
>
> We would like to conduct a Replica-exchange simulation with distance restraint. But I'm not quite sure if these two processes (Replica-exchange simulation and distance restraint with "nmropt=1") can be applied simultaneously in AMBER8.
>
>Any information will be appreciated.
>
>Thank you in advance
>
>Wenfei Li
>
>Institute of Biophysics,
>Nanjing University
>P. R. China
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