CCL: methods

From: "kamarul pet" <kamarul_pet*yahoo.com>
Subject: CCL: methods
Date: Tue, 5 Aug 2008 23:59:26 -0400

 Sent to CCL by: "kamarul  pet" [kamarul_pet^_^yahoo.com]
 Hi all,
 I just want to check my structure is wright or wrong. I doing molecular dynamics
 using Hyperchem (Amber parameter) in vacuo experiments.
 1. get structure from CCDDC
 2. delete water and add double bond
 3. add hydrogen
 4. do optimization for the structure
 5. insert charge using AM1single point.
 Can someone confirm to me my methods is right or wrong?