[AMBER] how to extract temperatur and other data from mdout

From: setyanto tri wahyudi <stwahyudi.gmail.com>
Date: Mon, 2 Aug 2010 10:45:20 +0700

Dear Amber user and developer

As we got from production run, output data, *.mdout, contain information
about temperature, density, energy, vDW and etc per timestep.

How can we extrat this data ? Example, I'd like to know energy vs timestep,
or temperature vs timestep, etc.

Thank you for your attention

Sincerely yours

Setyanto Tri Wahyudi
------------------------------------------
Laboratorium Biokimia Komputasi
Program Studi Kimia
Sekolah Pascasarjana Kimia
Institut Teknologi Bandung
Bandung-Indonesia
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Received on Sun Aug 01 2010 - 21:00:03 PDT
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