Copyright © 2018, Molsoft LLC
Jan 4 2018
[ Ph4 object faq ]
ICM can define a specialized object that can be used to as a generalized description of several ligands binding to the same pocket (a pharmacophore), or a fragment of the binding surface.
A pharmacophore object, in contrast to regular atomic objects contains disconnected "centers" representing different interaction types and chemical fragments oriented in space.
Here are the main characteristics of the ICM pharmacophore objects.
|Copyright© 1989-2018, Molsoft,LLC - All Rights Reserved. Copyright© 1989-2018, 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.|