nil5two at gmail.com
Sat May 28 14:19:32 CEST 2016
will you please guide me. how can I do this?
On May 28, 2016 5:11 PM, "Justin Lemkul" <jalemkul at vt.edu> wrote:
> On 5/28/16 3:59 AM, Nilkanta Chowdhury wrote:
>> Hello friends,
>> I want to simulate a protein molecule boud with a
>> Fe4S4 molecule, in gromacs. How do i generet the topology og this fe4s4
> You need to obtain/derive parameters for it. That's not a simple species
> to deal with.
> Justin A. Lemkul, Ph.D.
> Ruth L. Kirschstein NRSA Postdoctoral Fellow
> Department of Pharmaceutical Sciences
> School of Pharmacy
> Health Sciences Facility II, Room 629
> University of Maryland, Baltimore
> 20 Penn St.
> Baltimore, MD 21201
> jalemkul at outerbanks.umaryland.edu | (410) 706-7441
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