ظ Re: AMBER: the problem of mdcrd

From: xiphias xie <xiphiasxp.yahoo.com.cn>
Date: Tue, 17 Jan 2006 10:23:00 +0800 (CST)

--- Vlad Cojocaru
<Vlad.Cojocaru.eml-r.villa-bosch.de>д:

> what I don't really understand from your script is
> why the initial
> temperature (tempi) is 356 while the temperature
> that you want to keep
> your system (temp0)is 300 ....
>
> vlad
>
thanks for your attention .
tempi 356 is the reaction temperature.
temp0 300 is the crystallizing temperature.
I am not sure it is acceptable by this way .
All the best !
                          xiphias


        

        
                
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Received on Tue Jan 17 2006 - 06:10:07 PST
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