Re: [AMBER] On Cationic Dummy Atom

From: francesco oteri <francesco.oteri.gmail.com>
Date: Thu, 29 Sep 2011 11:26:32 +0200

Hi Kirtana,
I dont know how parametrize new residues so I cannot help you. I will
forwar(d your mail on the AMBER mainling list

Francesco

2011/9/29 kirtana S <skirtana4.gmail.com>

> I read your email on AMBER list on Zinc parameters. I am very new to
> generating non standard residue parametrization . I am using gold-sulphur
> ligated structures and also cobalt nanoparticles, I was wondering what can I
> use to derive parameters for some non standard residues.I can get parameters
> for angles and bond lengths from literature while I get stuck up on
> calculation of dihedral phase angles .
> Can you suggest how should I go about this.
>
> Thanks
> Kirtana
>
>
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Received on Thu Sep 29 2011 - 02:30:03 PDT
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