AMBER Archive (2006)

Subject: Re: AMBER: how to include EXTRA POINTS in AMBER8

From: David A. Case (case_at_scripps.edu)
Date: Mon Dec 04 2006 - 10:23:15 CST

On Mon, Dec 04, 2006, Rachel wrote:
>
> I have been trying to include some massless extra points in my system,
> however not successful, and the program kept complaining that 'vlimit
> exceeded for step 0, vmax=infinity',

First, did you try making the masses non-zero to see if the error changes or
goes away?

Second, do the names of your extra point atoms begin with the letters "EP"?

...dac
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