AMBER Archive (2009)

Subject: [AMBER] QM/MM simulation

From: gaurav panwar (gauravniperpi_at_gmail.com)
Date: Thu Sep 03 2009 - 15:11:42 CDT

I want to do QM/MM simulation of my docked protein but i am not sure how to
specify docked ligand atoms in input files for QM calculations. Please send
me suitable informations. 

-- 

Gaurav Panwar
M.S.(Pharm)
Center for Pharmacoinformatics
National Institute of Pharmaceutical Education and Research
Mohali
Contact no: 9914519541
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