AMBER: Setting box dimensions in leap

From: Jennie Thomas <jenniet.uci.edu>
Date: Fri, 28 Apr 2006 15:42:38 -0700

Hello Amber users,

I'm using leap to build a system that has the following cell dimensions:

a = 15.198A
b = 15.198A
c = 16.580A

alpha = 90 deg
beta = 90 deg
gamma = 120 deg

I can set the box dimensions using:
set sys box {15.198 15.198 16.58}

But, how do I specify the angles? Should I just fix them in the
resulting coordinate file?

Thanks so much!
Jennie Thomas
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Received on Sun Apr 30 2006 - 06:07:11 PDT
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