Oct 25 2010 Feedback.
Contents
 
Introduction
How Tos & Videos
Getting Started
Protein Structure
 Search PDB
 Convert
 Pocket Surface
 Hydrogen Bonds
Molecular Graphics
Slides and Documents
ActiveICM
Protein Superposition
Tutorials
 
Index
Prev
4.2 Converting PDB Files Into ICM Objects
Next

If you are going to make any energy calculation in ICM (eg docking, display H-bonds, display electrostatic and binding property surfaces etc..) it is necesary to convert a protein or chemical into an ICM object.

To convert a PDB structure into an ICM object follow the steps shown below:

  • Right click on the name of the protein you wish to convert in the ICM Workspace.
  • A dialog box will be displayed.Check the boxes as desired. If you are performing important calculations then it is necessary to optimize all hydrogens and ASN, GLU, PRO, and CYS.

If your object is an ICM object it will tell you in the ICM Workspace:


Prev
Header
Home
Up
Next
Pocket Surface

Copyright© 1989-2010, Molsoft,LLC - All Rights Reserved.
This document contains proprietary and confidential information of Molsoft, LLC.
The content of this document may not be disclosed to third parties, copied or duplicated in any form,
in whole or in part, without the prior written permission from Molsoft, LLC.