AMBER Archive (2007)

Subject: Re: AMBER: manganese ion

From: Guillermo Mulliert Carlín (Guillermo.Mulliert_at_lcm3b.uhp-nancy.fr)
Date: Tue Jul 10 2007 - 03:39:40 CDT

Hello,

On Mon, 9 Jul 2007, Davide Moiani wrote:

|> Hi everybody,
|> I need to simulate a protein with two manganese ions , before to make a library
|> i ask if someone had simulated before and could send me a library or the
|> coefficents to put in the parm99.dat.

        Have you take a look at
        http://amber.scripps.edu/
        Contributed parameters database, maintained by Richard Bryce at the University of Manchester

under Ions there are parameters for Mn(2+)

                                                Hope this help

                                                Guillermo Mulliert

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