> The openMM can do it. (https://simtk.org/home/openmm)
> YT
If you really believe that this is running 'sander' input and actually
producing 'sander' output.
Try some NVE runs with it.
Caveat emptor.
Just my 3c.
Ross
/\
\/
|\oss Walker
---------------------------------------------------------
| Assistant Research Professor |
| San Diego Supercomputer Center |
| Adjunct Assistant Professor |
| Dept. of Chemistry and Biochemistry |
| University of California San Diego |
| NVIDIA Fellow |
|
http://www.rosswalker.co.uk |
http://www.wmd-lab.org/ |
| Tel: +1 858 822 0854 | EMail:- ross.rosswalker.co.uk |
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Received on Mon Oct 25 2010 - 23:30:02 PDT
