AMBER Archive (2009)

Subject: Re: [AMBER] Non-Standard Atoms

From: Jack Shultz (js_at_drugdiscoveryathome.com)
Date: Sun Dec 20 2009 - 18:40:26 CST

Looks like my Amber Tools install had some issues.

On Sun, Dec 20, 2009 at 2:02 PM, case <case_at_biomaps.rutgers.edu> wrote:
> On Sat, Dec 19, 2009, Jack Shultz wrote:
>
>> First, I seem to get an error when I open tleap: frcmod.ff99SB not found.
>
>> tleap -s -f /usr/local/antechamber-1.27/dat/leap/cmd/leaprc.ff99SB
>
> Looks(?) like you need to update to the AmberTools version of antechamber.
> The file you want would be in /usr/local/antechamber-1.27/dat/leap/parm,
> but you might not have that file if your antechamber is an older version.
>
> Antechamber 1.27 comes from 2006; I will update the web page so that it
> no longer appears.
>
> Note to developers: try to avoid saying something is "current" or "new" on a
> web page.  That can get outdated real fast....
>
> ...dac
>
>
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> 

-- 
Jack

http://drugdiscoveryathome.com
http://hydrogenathome.org

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