[gmx-users] GROMACS: Few questions

Justin Lemkul jalemkul at vt.edu
Tue Jul 22 22:15:26 CEST 2014

On 7/22/14, 4:09 PM, lswierczewski . wrote:
> Thanks for the quick reply.
> Could you give some examples of good and the currently
> recommended QM packages?

Read manual section 6.11 and see which software fits your needs.



Justin A. Lemkul, Ph.D.
Ruth L. Kirschstein NRSA Postdoctoral Fellow

Department of Pharmaceutical Sciences
School of Pharmacy
Health Sciences Facility II, Room 601
University of Maryland, Baltimore
20 Penn St.
Baltimore, MD 21201

jalemkul at outerbanks.umaryland.edu | (410) 706-7441


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