QMMM without MM - ab initio MD

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10:20:49 AM PDT - Tue, Oct 20th 2015
Hi,

I was wondering if it was possible to run ab initio dynamics using the qmmm package? Is it possible to simply use QM without a force field, so just use QM to generate the forces? I'm not too familiar with the QMMM package so any help would be appreciated.



Thanks


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