Re: [AMBER] Probelm with antechamber for resp charge derivation

From: David A Case <case.biomaps.rutgers.edu>
Date: Wed, 25 Sep 2013 07:33:08 -0400

On Wed, Sep 25, 2013, Fengxue Li wrote:

> Info: the number of the path atoms exceeds MAXPATHATOMNUM(10000) for
> atom[109],extend the size and reallocate the memory automaticall

This is just an information message; it is not an error.

See also Francois' reply about breaking large molecules into fragments.

...dac


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Received on Wed Sep 25 2013 - 05:00:02 PDT
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