Re: AMBER: bad atom type: Li

From: David A. Case <>
Date: Tue, 26 Sep 2006 23:03:56 -0700

On Thu, Sep 21, 2006, jitrayut jitonnom wrote:

> [vannajan.localhost peo8pei32li20clo20]$ bad atom type: Li

You are apparently asking to carry out surface area calculations, but there
are no surface area parameters for lithium. (A surface area model would not
make much sense for ionic compounds like this.)

Would some developer please provide a patch to give a better error message

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Received on Sun Oct 01 2006 - 06:07:02 PDT
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