AMBER Archive (2005)

Subject: AMBER: question about grid in ptraj

From: Linchen Gong (glc0358_at_vip.sina.com)
Date: Thu Oct 06 2005 - 08:03:00 CDT

Hello everyone,
I want to know the meaning of output data generated by grid command in ptraj.
for example, if I have
"grid dense_out 70 1 70 1 70 1 :WAT max 0.5"
in my input file for ptraj
what is the physical meaning of output density

I don't know whether I have put it clear.
Thanks a lot!

______________________________________
Linchen Gong
basic science class
math and physics oriented
Department of physics
Tsinghua University
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