[AMBER] about IGB

From: geyan <geyan.big.ac.cn>
Date: Sat, 24 Apr 2010 09:08:51 +0800

Has anybody met this problem before?when performing sander by turning on the IGB flag,in my case doing minimization with IGB=1,I got the err output maily printed NaN and the rst file produced all reads NaN.As long as I turn it off,everything becames OK.Does anybody know what is wrong and how to figure it out?
         Due to my negligence to clean up my Inbox of my email,I release this issue again,sorry.
appreciate anyone's help.

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Received on Fri Apr 23 2010 - 18:30:02 PDT
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