AMBER Archive (2009)

Subject: [AMBER] Copper semiempirical parameters

From: Jacopo Sgrignani (sgrignani_at_cerm.unifi.it)
Date: Thu Jun 11 2009 - 08:49:50 CDT

Dear all
i would like to simulate with the QM/MM a copper atom in a protein.
Could anybody suggest me where to find the parameters to do it, and the
best method to simulate the copper in Amber.

tanks a lot

Jacopo

_______________________________________________
AMBER mailing list
AMBER_at_ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber