[gmx-users] GROMACS API?

[Ben FrantzDale]

I am interested in using GROMACS as a library. I get the impression from its
use in Folding at Home that this is possible, but I don't see any documentation
on the subject. Is there a C/C++ API for GROMACS so that I could initialize
GROMACS with an MPI communicator then send it jobs to process? If so, did I
just not find the documentation?

Thanks.

—Ben
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20070206/4e0e470c/attachment.html>