AMBER Archive (2009)

Subject: Re: [AMBER] atom number exceeds the MAXATOM when running antechamber

From: Gustavo Seabra (gustavo.seabra_at_gmail.com)
Date: Tue Jun 02 2009 - 10:04:33 CDT

On Mon, Jun 1, 2009 at 8:53 AM, xueqin pang <pangxueqintea_at_yahoo.com.cn> wrote:
> Hello everyone,
>
> when running antechamber, I got the Info: "the atom number exceeds the
> MAXATOM, reallocate memory automatically". Dose it matters and if it does,
> how can I change the MAXATOM ?

If it is allocating more memory automatically, you should be OK. This
is just a warning, and that will not influence your results.

http://archive.ambermd.org/200605/0219.html

Gustavo Seabra
Postdoctoral Associate
Quantum Theory Project - University of Florida
Gainesville - Florida - USA
-------------------------------------------------------------------------------------------
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A: To prevent the sensible ones from going home.

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