[AMBER] about setting nscm

From: kirtana S <skirtana4.gmail.com>
Date: Tue, 1 Jul 2014 12:27:58 -0400

Dear Amber Users,

In my production run simulation which is performed after equilibrating the
system ntt=3 was used . If I am using nscm 100, Will this alter the
velocities or affect transport properties.

For the production run I am using

ntt=3, gamma_ln=0.5,
ncsm=100,nsnb=100,
ntb=2,ntp=1,

Thanks
Kirtana
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Received on Tue Jul 01 2014 - 09:30:04 PDT
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