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Worldwide Status and Outlook: Molecular Modeling for Nanotechnology: Technologies, Applications, & Market Outlook


Description: This new market research study analyzes the core technologies, applications, and advantages of molecular modeling for nanotechnology. It also includes internationl trends, issues, and comparisons of key government activities in France, United Kingdom, Japan, and United States. Additionally, this report profiles the activities of 14 major molecular modeling software companies and 19 representative users/customers in Europe, Japan, and United States.

As revealed in the report, molecular modeling methods have become significant tools in nanoscale R&D in a variety of industries including:

Commodity and specialty chemicals;
Fuels, polymers, glass, and structured materials;
Electronic and photonic materials;
Industrial gasses;
Personal care and food products;
Computer software and hardware;
Agricultural chemicals.

This report is available in both English and Japanese editions.


Contents: 1. INTRODUCTION AND OVERVIEW
1.1. Modeling at the Nanoscale
1.2. Types of Molecular Modeling Software

2. SCIENCE OF SIMULATION
2.1. Electronic Structures, Thermochemistry and Kinetics
2.2. Molecular Simulations and Mesoscale Methods
2.3. Information Technologies
2.4. Computer Graphics
2.5. QSAR/QSPR

3. CORE TECHNOLOGIES
3.1. Molecular Graphics
3.2. Atomistic Simulation
3.3. Quantum Mechanics
3.4. First Principles Methods
3.5. Semi-Empirical Methods
3.6. Mesoscale Modeling
3.7. Nanoscale Modeling

4. APPLICATIONS FOR MATERIALS MODELING
4.1. Catalysis, Separations, and Reactions Modeling
4.2. Applications of Crystallization and Additives Modeling
4.3. Applications of Formulations and Mixtures
4.4. Applications of Polymers and Colloids Modeling
4.5. Applications of Materials Characterization and Design
4.6 Applications of Solid State and Surface Chemistry Modeling

5. APPLICATION AREAS
5.1. Aerospace Industry
5.2. Agrochemicals Industry
5.3. Automotive Industry
5.4. Ceramics and Glass Industry
5.5. Electronics Industry
5.6. Chemicals
5.7. Metals Industry
5.8. Pharmaceuticals Industry
5.9. Plastics and Rubber Industry

6. MARKETS

7. MOLECULAR MODELING MARKETS AND OUTLOOK
7.2. Key Sectors Impacted by Molecular Modeling
7.2.1. Chemicals
7.2.2. Pharmaceuticals and Life Sciences
7.2.3. Defense and Aerospace
7.2.4. Manufacturing
7.2.5. Electronics
7.3. Total Market Outlook, 2003-2008

8. INTERNATIONAL TRENDS, ISSUES AND COMPARISONS
8.1. Key European Government Activities
8.1.1. France
8.1.1.1.CNRS (Centre National de la Recherche Scientifique)
8.1.2. French Petroleum Institute (Institut Francais du Petrole)
8.2. United Kingdom
8.2.1. Daresbury Laboratory, Computational Science and Engineering
8.3. Japan
8.3.1. Platform for Developing High Function Materials ("Doi Project")
8.3.2. Institute for Molecular Science
8.3.3. Institute for Solid State Physics
8.4. United States
8.4.1. National Institute of Standards and Technology, Center for Theoretical and Computational Materials Science (CTMS)
8.4.2. Department of Defense High Performance Computing Modernization Program (HPCMP)
8.4.3. Air Force Aeronautical Systems Center
8.4.4. NASA, Ames Research Center

9. ACTIVITIES OF MAJOR MOLECULAR MODELING SOFTWARE COMPANIES
9.1. Accelrys
9.2. AngstroVision
9.3. Celestry
9.4. Cambridgesoft
9.5. Cray
9.6. Hypercube
9.7. Kelvin Nanotechnology
9.8. Nanomechanics
9.9. Nanomix
9.10. NanoTitan
9.11. New River Kinematics
9.12. Tripos
9.13. WaveFunction
9.14. Zyvex

10. ACTIVITIES OF REPRESENTATIVE USERS/CUSTOMERS
10.1. EUROPE
10.1.1.Aventis (formerly Rhone-Poulenc)
10.2. BASF
10.2.1.Bayer
10.2.2.DaimlerChrysler
10.2.3.IBM Zurich Research Laboratory
10.2.4.L'Oreal
10.2.5.TotalFinaElf
10.2.6.Unilever
10.3. JAPAN
10.3.1.Asahi Chemical Industry Company
10.3.2.Fujitsu
10.3.3.Mitsubishi Chemical Corp
10.3.4.NEC
10.3.5.Toshiba
10.3.6. Toyota
10.4. UNITED STATES
10.4.1.3M
10.4.2.Air Products and Chemicals
10.4.3.Chevron Corp
10.4.4.Dow Chemical
10.4.5.Motorola
10.4.6.Rohm and Haas




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