[AMBER] -a flag :RESP

From: Jio M <jiomm.yahoo.com>
Date: Sun, 19 Jul 2009 11:48:20 +0100

Dear AMBER users,

I didnt find tutorial for AMBER10 to make group charge to be zero.
 I have a query regarding use of -a flag in respgen.. can we use it in respin1  as well  as  respin2?

the .in file contains

following commands were used

respgen -i eda_v_esp.ac -o eda.respin1 -f resp1 -a eda_v.in

somebody pls help as no such tutorial I have found for AMBER 10 to make group charge to be zero.



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Received on Sun Jul 19 2009 - 10:08:03 PDT
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