[gmx-users] force field parametrs for Mn2+

tarak karmakar tarak20489 at gmail.com
Mon Jul 9 19:42:53 CEST 2012


sorry it's my mistake .........
thanks a lot for the reply.

On Mon, Jul 9, 2012 at 10:55 PM, Justin A. Lemkul <jalemkul at vt.edu> wrote:
>
>
> On 7/9/12 1:21 PM, tarak karmakar wrote:
>>
>> Oh !! nice work
>> Thanks a lot for the quick reply. But I'm very sorry to inform you
>> that whichever table [supplementary table S4] you are specifying in
>> the supporting info, I couldn't find anywhere. So, may be I'm finding
>> my way in wrong track. Can you please provide me the link and / the
>> table containing the parameters for the Manganese ?
>
>
> It's on p. 11 of the supplement.
>
> http://onlinelibrary.wiley.com/store/10.1002/anie.201202032/asset/supinfo/anie_201202032_sm_miscellaneous_information.pdf?v=1&s=cff1986017d1843da85eb75dbd174c8e11727dc8
>
> -Justin
>
> --
> ========================================
>
> Justin A. Lemkul, Ph.D.
> Research Scientist
> Department of Biochemistry
> Virginia Tech
> Blacksburg, VA
> jalemkul[at]vt.edu | (540) 231-9080
> http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
>
> ========================================
>
>
>
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-- 
Tarak Karmakar
Molecular Simulation Lab.
Chemistry and Physics of Materials Unit
Jawaharlal Nehru Centre for Advanced Scientific Research
Jakkur P. O.
Bangalore - 560 064
Karnataka, INDIA
Ph. (lab) : +91-80-22082809



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