Random selection of molecules from cluster

Name: Random selection of molecules from cluster(s)

Author: Carol Gorst

Version: 1.0

Created: 8/2003

Modified: 8/2007

Purpose: This protocol will cluster molecules, group them by clusters and select a random percentage of molecules from each cluster.

Requirements: PP Server 6.1.1, Chemistry Collection, Data Modeling Collection

O/S: Any

Keyword: HTS, clustering

Contents: Random Percent from Cluster.xml

Installation: Run as-is to see a demo. Then upload the protocol to Pipeline Pilot, replace the NCI drugs reader component with the molecule file reader of your choice.