[gmx-users] Modified Gromacs and OPENMM
Justin A. Lemkul
jalemkul at vt.edu
Fri Apr 29 22:08:55 CEST 2011
Chi-cheng Chiu wrote:
> Hi Gromacs users & developers,
> If I modified gromacs, will my modification works if I complied it with
> OPENMM and use GPU?
Presumably, if you have written sound code that uses compatible functions that
are actually implemented in the OpenMM library, then yes. If you want a more
specific answer, you'll have to be more specific about what "modified Gromacs"
actually means.
-Justin
> Thanks!
>
> Regards,
>
> Chi-cheng
>
--
========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
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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