[gmx-users] CPMD- QM MM simulation

[Chih-Ying Lin]

Hi
I read some papers, which the authors use CPMD - QM MM simulation
to reparametrize the force field parameters.

But, they did not say the details.
Could anyone explain this more here?


Thank you
Lin
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20080905/c148ec76/attachment.html>