MDL® Discovery Framework
MDL® Discovery Experiment Management
MDL® Discovery Knowledge
MDL® Discovery Predictive Science
Database Finder
Product Finder
Product Matrix
Solutions for Research Scientists
Solutions for Information Technologists
Solutions for Research Managers
Solutions for Information Scientists
Solutions for Academics
Case Studies
White Papers
Strategic Consulting
Custom Projects
Tactical Problem Solving
On-Site Assistance
Classroom Training
Web-Delivered Training
Custom Documentation
Knowledge Base
Support Programs
Contact Support
Developer Support
Download Products
Latest Releases
Search by Area of Interest
Search by Type
Advanced Search
MDL
Search
Home Company Info Site Map Contact
 
Register Login
 
Powering the Process of Invention
Products
MDL® Discovery Framework
MDL® Discovery Experiment Management
MDL® Discovery Knowledge
  MDL® Discovery Predictive Science
   MDL® ISIS for Excel
   MDL® Report Manager
   MDL® Carcinogenicity Module
   MDL® Decision Manager
   MDL® Metabolite Database
   MDL® QSAR
   MDL® Sculpt
   MDL® Toxicity Database
   Partek® Pro
   Pipeline Pilot™
   RTECS®
Products Solutions Consulting Education Support Downloads
Home > Products > MDL® Discovery Predictive Science
 
Products MDL® Discovery Predictive Science
MDL QSAR
Featured Product: MDL® QSAR
MDL® QSAR: MDL QSAR is a comprehensive QSAR modeling system that lets scientists establish reliable quantitative structure-activity and structure-property relationships, create new calculators for in silico screening, and generate new compound libraries based on results—accelerating the discovery of lead compounds in drug and agrochemical research. By providing powerful computational tools in a user-friendly environment, MDL QSAR supports a highly effective drug discovery workflow across all project team disciplines.
MDL® Discovery Predictive Science

MDL® Discovery Predictive Science helps scientists assess properties of compounds for which complete experimental data are not available. These applications enable collaborative assessment of compounds and support decisions throughout a discovery project. This is done through a series of offerings from MDL and third parties including statistical analysis, predictive modeling, visualization, and chemically intelligent content.

Article in Bio.IT World

Mining Data via n-Tier Architecture
by Seth Pinsky, in Bio.IT World 2004 Information Technology + Informatics Buyer's Guide for the Life Sciences, page 155.


MDL® ISIS for Excel Spreadsheet access to structures and data
MDL® Report Manager A comprehensive reporting tool for biological and chemical data
MDL® Carcinogenicity Module A predictive software module, made in collaboration with the USFDA, to predict long term carcinogenicity risk
MDL® Decision Manager A project collaboration, access and management workspace
MDL® Metabolite Database Metabolism information system
MDL® QSAR Comprehensive QSAR modeling system
MDL® Sculpt 3D structural visualization and analysis
MDL® Toxicity Database Toxic properties of chemical substances
Partek® Pro Statistical and visual analysis software
Pipeline Pilot™ A high-throughput data analysis and mining system for drug discovery informatics
RTECS® The Registry of Toxic Effects of Chemical Substances

 

What's New
 
Events:
 
01-Feb-04
LabAutomation 2004
 
04-Mar-04
2004 MDL UK Users' Group Meeting
 
08-Mar-04
2004 MDL European Users' Group Meeting
 
 
Press Releases:
 
03-Dec-03
BASF selects MDL® IsentrisTM as foundation for global research
 
11-Nov-03
MDL® Plate Manager simplifies and streamlines compound management
 
07-Nov-03
MDL® to introduce new patent chemistry database in 2004
 
 
Related Courses:
 
Optimizing Lead Selection
 
Searching the Metabolite Database
 
Retrieving Toxicity Data
 
Registering Metabolism Data
 
Building a Basic QSAR Model
 


Terms of Use . © Copyright 2003 MDL Information Systems, Inc. All rights reserved.
This site is optimized for Microsoft Internet Explorer 5.0 or higher or Netscape 5.0 or higher.
Status: Not Logged In.
Language Home Directory: ''
Sessionid: joel.mdli.com-78d%3A3fd3144d%3A47e9421f647f640