[AMBER] REMD equilibration restart

From: Sangita Kachhap <sangita.imtech.res.in>
Date: Sun, 30 Jan 2011 13:15:45 +0530 (IST)

Hello all,

I am runing REMD, first I was equilibrating it for 1ns but it stoped after ~835ns.
I am runing tow separate REMD for am amino acid (one as refrence) in my protein
one is runing still.
Since in equilinration there is no exchange of replica, So can I restart
equlibration from where it has stoped?


Can please anybody suggest me?

With regard
Sangita Kachhap
JRF
BIC,IMTECH
CHANDIGARH


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Received on Sun Jan 30 2011 - 00:00:08 PST
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