Topics

Computational Chemistry and Molecular Modeling

• Java Applications in Chemistry
• The Encyclopedia of Computational Chemistry
• American Chemical Society Computers in Chemistry Division
  
• Monte Carlo Simulation Home Page
  
• Chemistry Animation Project
  
• Animations
  
• WATOC: World Association of Theoretically Oriented Chemists
  
• Molecular Design Institute - University of California, San Francisco
  
• Molecular Modeling
  
• Electronic Conference In Molecular Modeling and Computational Chemistry
  
• Computational Chemistry for Chemistry Educators
  
• Proceedings of the First Electronic Computational Chemistry Conference (CD ROM Version)
  
• Chemical Examples of VRML (Virtual Reality Modelling Language)
  
• Nanotechnology
  
• The National Institutes of Health Molecular Modeling Home Page
  
• Gateway to The NIH Guide to Molecular Modeling
  
• The NIH Guide to Molecular Mechanics
  
• The NIH Guide to Molecular Dynamics
  
• The NIH Guide to Quantum Chemistry
  
• Molecular Modeling (Department of Chemistry, Wake Forest University, NC, USA
  
• Mopac Notes
  
• CAUT Computational Project
  
• Java Applet: SCF-LCAO Calculation of the (1s)2 Ground State of the Helium Atom
  
• Protein Modelling Program (at UCSF)
  
• The Alchemy Web Site
  

• Compiling and Running Gaussian 94 Under Linux
• Hückel Calculator
• EMSL Gaussian Basis Set Order Form European Mirror Service at CCLRC Daresbury, UK
• Gaussian benchmarks
• Cálculo de Gaussian sobre la molécula de agua: hágalo usted mismo!

• NMR Spectroscopy on the Electronic Highway
  
• Magnetic Resonance Home Page
  
• NMR meets Musicians: Auditory Presentation of Free Induction Decay (FID) Signals Generated by NMR Spectrometers (University of Erlangen-Nuremberg)
  
• Bruker: NMR Division
  
• Bruker Optics (Bruker FT- IR/Raman Division)
  
• JEOL USA, Inc.
  
• Varian
  
• Electron Paramagnetic Resonance Spectroscopy
  
• IR Spectroscopy on the World Wide Web
  

• Cristallography in Europe
  
• VRML (Virtual Reality Modeling Language): a short introduction crystallography-oriented
  
• International Union of Crystallography
  
• X-Ray WWW Server (Upsala University, Sweden)
  
• American Crystallographic Association
  
• EMSL Gaussian Basis Set Order Form

• Phoenix Polymers, Inc.
  
• The Plastics Network
  

• Complete listing of animations produced with QUANTA
• Surface Visualisation with Chime and Rasmol
• Chemist's Art Gallery
• MathMol Library of 3-D Molecular Structures

• Nanotechnology
  
• The QSAR and Modelling Society
  
• Chromatography & Electrophoresis
  
• NIH GenoBase Database Gateway
  
• ChemDex: The Sheffield Chemistry Internet Sites at Companies
  
• North Carolina State University Mass Spectrometry Facility
  
• Bruker Mass Spectrometry
  
• International Society of Heterocyclic Chemistry
  
• The Electrochemical Society
  
• PhytoCenter
  
• Herbs: medicinal use
  
• Reactivité en Milieux Ioniques Liquides
  
• Arizona Fullerene Consortium
  
• National Center for Biotechnology Information - GenBank
  
• Beckman Instruments, Inc.
  
• Perkin Elmer - Product/Applications Guide
  

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