| 11:52:28 AM PDT - Fri, Apr 5th 2013 |
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Mikiya,
Yes, NWChem can do that. See http://nwchemgit.github.io/index.php/Release61:QMMM for details on our QM/MM implementation.
Depending on the version of NWChem you are using, you can also add arbitrary point charges (for example to generate a Madelung potential). See http://nwchemgit.github.io/index.php/Release62:Bq . This the documentation of the upcoming release, but this functionality should already be in NWChem-6.1.1
Bert
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