[gmx-users] qm-mm calculation : Gromacs + cpmd

Nilesh Dhumal ndhumal at andrew.cmu.edu
Mon Dec 22 16:38:36 CET 2014


Hello,

I am planning to qm mm simulation with Gromacs + cpmd.

Can I interface recent gromacs version (4.5.5) with cpmd (3.17.1)?

Where can I find the information about interface?

Thanks,

Nilesh



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