| ★ACD IUPAC |
| Advanced Chemistry DEvelopment announced the release of FREE versions of their IUPAC Naming software available both online and as PC-based packages |
| ★IUPAC Compendium of Chemical Terminology - the Gold Book |
| ★RasMol and OpenRasMol |
| RasMol is a program for molecular graphics visualisation originally developed by Roger Sayle. |
| ★ChemSketch 4.5 |
| Quickly and easily draw molecules in a chemistry-oriented interface. |
| ★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. |
| ★PDB KineMage |
| age is a 3D vector display program which shows "kinemage graphics. |
| ★Daylight |
| Daylight provides enterprise-level cheminformatics software technologies to life science companies. |
| ★VCCLAB (Virtual Computational Chemistry Laboratory) |
| The VCCLAB is a collaborative project funded by INTAS (2001-2004). |
| ★World Wide Molecular Matrix |
| This is a inter convertion site for chemical structure files at Unilever Centre for Molecular Informatics,Chemistry Department, University of Cambridge, CB2 1EW, UK. |
| ★WebMolecules |
| WebMolecules -- an active, sponsor-supported site designed for the 3D visualization of molecules. |
| ★AutoNom 2.1 |
| AutoNom 2.1 (AUTOmatic NOMenclature) is a program of Beilstein which generates IUPAC names FREE directly from graphical structures entered via the web. It's free now on ChemWeb. |
| ★Chemical Structure Drawing Software |
| Alexander Nezlin is a QC Manager at CTS Chemical Industries Ltd., an Israeli Pharmaceutical Company. |
| ★ChemVis |
| ("Distributed Processing and Exchange of Digital Documents) of the German Research Foundation (Deutsche Forschungsgemeinschaft DFG). |
| ★IUPAC |
| The HTML reproduction of the IUPAC Nomenclature of Organic Chemistry is published by Advanced Chemistry Development, Inc. with permission of the IUPAC. |
| ★ChemOffice Net 5.0 |
| ChemOffice Net 5.0 is a print- and save-disabled demo version of ChemOffice Pro 5.0, |
| ★CORINA |
| CORINA has been developed in the research group of Prof. |
| ★KnowItAll Informatics System 2.0 |
| HaveItAll IR Datasheet HaveItAll IR puts the world's largest infrared spectral collection of over 220,000 spectra of pure organic and commercial compounds all on one CD for secure searching from your desktop. |
| ★MolScript |
| MolScript is a program for creating schematic or detailed molecular graphics images from molecular 3D coordinates, usually, but not exclusively, protein structures. |
| ★ChemIntosh |
| ChemIntosh is a chemical structure drawing application for the Macintosh platform. |
| ★Web Torvs Research Team |
| This collection of pages consists of demonstrators and research prototypes for Internet-based chemical information services. |
| ★KnowItAll Academic Edition |
| The KnowItAll Academic Edition is available by download at no charge for professors, other faculty, and students at degree-granting institutions. |
| ★3D Molecular Designs |
| 3D Molecular Designs, LLC produces accurate, three-dimensional physical models of proteins and other molecular structures using rapid prototyping technology. Models are based on x,y,z coordinates obtained from pdb files of known structures. |
| ★3DFS |
| 3DFS is distributed free of charge for academic and non-commercial use and designed to search NCI/NIH public 3D databases: NCI3D(127k), Cancer screened(32,443), AIDS screened(42,390) and Plated compounds (140k). |
| ★3D |
| This is one of the About site on 3D Graphics/Virtual Reality, with contents of scientific application by Laurel Miller-Daly. |
| ★ACD Structure Drawing Applet (ACD/SDA) |
| ACD Structure Drawing Applet (ACD/SDA) is a complete structure drawing, editing and visualization tool written in Java that can be incorporated into HTML documents. |
| ★BABEL |
| BABEL is a program designed to interconvert a number of file formats currently used in molecular moldeling. |
| ★CAMEO |
| CAMEO is a modular expert system, a computer program that predicts the products of organic reactions given starting materials, reagents and conditions. |
| ★Chemistry 4-D Draw |
| Chemistry 4-D Draw is a next-generation chemistry program combining the most advanced technologies in structure drawing with proprietary modules, NamExpert and Nomenclator, that understands IUPAC nomenclature rules. |
| ★Chemistry Development Kit (CDK) |
| The CDK classes are Java utitility classes for ChemoInformatics and Computational chemistry, written in Java. |
| ★ChemMine |
| ChemMine is a compound mining database that facilitates drug and agrochemical discovery and chemical genomics screens. |
| ★ChemPen3D |
| Do you need 3D molecular structures to analyze molecular geometry? to explore molecular mechanics? to analyze reaction energetics? If yes, ChemPen3D is the tool for you. |
| ★ChemSymphony |
| ChemSymphony comprises a toolkit of Java Beans components for Chemistry. |
| ★ChemTK Lite |
| ChemTK Lite is a free Windows toolkit providing chemists the ability to visualize, organize, query, and analyze chemical screening data. |
| ★DIMENSION 5 |
| Miner3D EXCEL:Interactive 3D and 2D visual data analysis, data mining, navigation, cherry picking, sonification, chart and report creation for advanced Microsoft Excel users. |
| ★DRAGON |
| DRAGON is a well-known software for the calculation of more than 1600 molecular descriptors from several input formats (MDL, SYBYL, HyperChem, Smiles). |
| ★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 to easily find and edit products or reactions records. |
| ★Gezelter Lab |
| The groups research is concerned with structural and dynamic processes in condensed phase systems like liquids, glasses, biological membranes and nanoparticles. |
| ★GlassyChemistry |
| GlassyChemistry. A chemsoft all in one |
| ★IUPAC-NIST Chemical Identifier (INChI) |
| A new test version of the IUPAC-NIST Chemical Identifier (INChI) is now available. |
| ★JChemPaint |
| JChemPaint is a Java 2 program for drawing 2D chemical structures like those found in most chemistry textbooks. |
| ★Java applet |
| JME Molecular Editor is a Java program which allows to draw, edit, and display molecules and reactions in a stand-alone mode or as an applet directly within an HTML page. |
| ★Jmol |
| Jmol was originally intended to be a fully functional replacement for XMol which was a molecular viewing program developed at the Minnesota Supercomputer Center. |
| ★JMV |
| JMV is a molecular viewer written in Java and Java3D. |
| ★KnowItAll’s ChemWindow Edition |
| KnowItAll’s ChemWindow? Edition is the most comprehensive chemistry publishing software available today. |
| ★MDL Chime |
| MDL Chime is a plug-in that interactively displays 2D and 3D molecules directly in Web pages. |
| ★MOLDA |
| MOLDA is a molecular-model building program (Molecular file formats are MOLDA, XMol, Chem3D, MDL Mol, PDB and CIF). |
| ★MOLMOL |
| MOLMOL is a molecular graphics program for display, analysis, and manipulation of three-dimensional structures of biological macromolecules, with special emphasis on nuclear magnetic resonance (NMR) solution structures of proteins and nucleic acids. |
| ★MolSoft 2D－3D |
| 2D to 3D converter convertion functionality allows construction of icm molecular objects from smiles-strings and creates optimized 3D structures |
| ★NCI-3D Database, NLM, NIH |
| 3D Chemical Structure Searching: NCI-3D Provided by the Specialized Information Services, U.S. National Library of Medecine, NIH. |
| ★Norgwyn Montgomery |
| Their molecuar modeling and chemical database software was developed by working industrial research chemists. |
| ★PharmTree |
| PharmTree is a Pharmacophore classifier for biological properties of chemical compounds. |
| ★RasMol |
| RasMol is a molecular graphics program intended for the visualisation of proteins, nucleic acids and small molecules. |
| ★SMILES |
| Input Format: your own SMILES strings or create a SMILES string using the Structure Editor. |
| ★SYBYL/Base |
| SYBYL/Base, the heart of Tripos Discovery Software, provides the fundamental components for understanding molecular structure and properties with a special focus on the creation of new chemical entities. |
| ★SynGen |
| SynGen is a unique program for automatic organic synthesis generation. |
| ★VHMPT |
| VHMPT is a graphical Viewer and editor for Helical Membrane Protein Topologies. |
| ★VMD |
| VMD is a molecular visualization program for displaying, animating, and analyzing large biomolecular systems using 3-D graphics and built-in scripting. |
| ★voidoo |
| VOIDOO is a program for detection of cavities in macromolecular structures. |
| ★VRML 2.0 Cosmo Player |
| Cosmo Player is a VRML viewer for web-based 3D interactives. |
| ★WebLab ViewerLite |
| With the WebLab Viewer you can create and visualize 3D molecular structures, analyze chemical features, and create stunning, interactive reports and presentations. WebLab Viewer is part of MSI's WebLab environment. |
| ★XML-CML |
| ML (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 and software tools to illustrate its form and its application,together with a list of some "frequently asked questions about CML and XML |
| ★3D VRML |
| The VRML File Creator for Chemical Structures is an online service for the generation of VRML scenes from your 2D or 3D data files. |
| ★Java ChemAxon (Marvin, JChem and more) |
| ChemAxon is a company specialized in the development of chemical software solutions for the biotechnology- and pharmaceutical industries. |
| ★DSMM |
| The purpose of this database is to provide an easily-searchable source of information about movies showing biomolecular motions that have been generated by computer simulation. |
| ★SMILES/InChI/Mol file 2D |
| www.InChI.info is a website dedicated to the International Chemical Identifier InChI. |
| ★Data Book of Molecules |
| About 800 molecular models can be viewed, and rotated on PC with the free Chemscape Chime plug-in. |
| ★ChemVis: VRML Animator for Chemical Structures and More |
