________________________________________
From: CHAMI F. [fatima.chami.durham.ac.uk]
Sent: Monday, January 21, 2013 4:52 PM
To: AMBER Mailing List
Subject: [AMBER] Charge relocation
Dear Amber users,
I would like to use the charge relocation featured in Amber 12 on a system of 100 to 1000 biphenyl molecules.
the "crin" is the option that defines the input file ... it is tidious way to generate this file by hand ..has any one
wrote a script so far
thanks
fatima
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Received on Wed Jan 23 2013 - 06:00:04 PST
