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  • Chemical Laboratory Management Program EXPEREACT
  • Expereact is a complete laboratory management program that includes, among others, the functions of stock keeping, laboratory notebook and chemical database search tools allowing t
  • Chemical Entities of Biological Interest (ChEBI)
  • Chemical Entities of Biological Interest (ChEBI) is a freely available dictionary of molecular entities focused on 'small' chemical compounds. The term 'molecular entity' refers to
  • CAMEO (Computer-Assisted Mechanistic Evaluation of Organic Reactions)
  • CAMEO is a modular expert system, a computer program that predicts the products of organic reactions given starting materials, reagents and conditions. The analyses primarily featu
  • BABEL: Interconvert a number of file formats in molecular modeling
  • BABEL is a program designed to interconvert a number of file formats currently used in molecular moldeling. The program is available for Unix (AIX, Ultrix, Sun-OS, Convex, SGI, Cra
  • World Index of Molecular Visualization Resources
  • World Index of Molecular Visualization Resources is a Visitor-Maintained Indices (VMI)TM Site by Eric Martz and Trevor D. Kramer. Server courtesy by Philip Bourne and the San Diego
  • MolScript
  • MolScript is a program for creating schematic or detailed molecular graphics images from molecular 3D coordinates, usually, but not exclusively, protein structures. The user suppli
  • ChemTK Lite
  • ChemTK Lite is a free Windows toolkit providing chemists the ability to visualize, organize, query, and analyze chemical screening data. Derived from ChemTK version 2.6, which now
  • ChemIntosh
  • ChemIntosh is a chemical structure drawing application for the Macintosh platform. The program includes structure checking, a pen tool, multiple undo's and Hot Keys. The Windows ve
  • Virtual Computational Chemistry Laboratory
  • The VCCLAB is a collaborative project funded by INTAS (2001-2004). The VCCLAB site provides free on-line calculations using a number of software tools: ALOGPS 2.1* program to predi
  • KineMage
  • Mage is a 3D vector display program which shows "kinemage" graphics. Used in both teaching and research, in applications ranging from estuary ecology to X-ray crystallogr
  • IUPAC Nomenclature of Organic Chemistry
  • The HTML reproduction of the IUPAC Nomenclature of Organic Chemistry is published by Advanced Chemistry Development, Inc. with permission of the IUPAC. The following IUPAC publicat
  • ISIS/Draw 2.3
  • ISIS/Draw is a chemically intelligent drawing package that enables you to draw chemical structures using the same intuitive signs and symbols used for paper sketches. 
  • Interactive depiction of SMILES
  • SMILES is a simple yet comprehensive chemical nomenclature. The "depict" algorithm generates a chemical structure diagram for any SMILES. 
  • XML-CML (Chemical Markup language) Software and Demo release
  • CML (Chemical Markup language) is the most mature and best developed and documented Chemical application of XML, and they have now made available an extensive range of resources an
  • VRML 2.0 viewer: Cosmo Player
  • Cosmo Player is a VRML viewer for web-based 3D interactives. Features: Supports Microsoft Direct 3D; Supports up to 8 simultaneous 3D scenes on the same HTML page; Support
  • UCI Machine Learning Repository
  • This is a repository of databases, domain theories and data generators that are used by the machine learning community for the empirical analysis of machine learning algorithms.
  • Spotfire
  • Spotfire is the leading provider of eAnalytic applications -- speeding the discovery, development, manufacture, and marketing of products across the extended enterprise. 
  • SigmaPlot: The Technical Graphing Standard
  • Large, Scientific Worksheets: Over 32,000 columns by millions of rows; Handles numeric, text (categorical), and date & time data; Automatically generate column statistics; Data
  • Process tools online, Process Associates of America
  • Most of the process engineering tools provided here are NOT suitable for real-life plant operation and/or design purposes. They are meant as a teaching aid for chemical engineering
  • Molecular Mass Calculation
  • [Input] a chemical molecular formula Input is case sensitive: Co=, CO=carbonmonoxide 
Periodic Table
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