Library

Structure Checker – in silico plastic surgery for molecules Presentation

checker
Chemical structures often suffer from various drawing errors. These errors may originate from actual drawing mistakes, or insufficient structure recognition and interpretation of structur…
September 2011 Author: ()
Product group: IT platform toolkit

The year of chemistry with JChem - formula search, unique structures, Markush, speed ups and more Presentation

forma1
This talk will detail the latest and future developments in the JChem server products: JChem Base, Cartridge, Web Services and Markush search. The new molecular formula search types will …
September 2011 Author: ()

Re-imagining Marvin Presentation

MarvinSketch and View Java Applets are established technologies for advanced chemical structure drawing and viewing on Web pages. The evolution of web technologies, the fall of Java on th…
May 2012 Author: ()

JChem enters Formula 1 (and formula search enters JChem) Presentation

szabolcs
This talk will detail the latest and future developments in the JChem server products: JChem Base, Cartridge, Web Services and Markush search. The new molecular formula search types will…
May 2011 Author: ()

Markush project: Introducing Markush DARC support Presentation

markush
The ChemAxon Markush project includes drawing, visualization and generation of Markush structures, Markush enumeration techniques and searching. The generic notation includes R-groups, at…
September 2010 Author: ()
Product group: Markush IP

Methods for robust and efficient tautomer enumeration, tautomer searching and  tautomer duplicate filtering Presentation

tautomer
Tautomerism is an important and difficult problem in cheminformatics, and has gained much attention recently. [1] The presentation will focus on ChemAxon’s approaches and algorithms…
September 2010 Author: ()
Product group: Discovery toolkit

Restoration of Molecular Artifacts: Structure checker and fixer framework for registration systems Presentation

structurechecker
Chemical structures sometimes contain various drawing errors and those originated from old databases often suffer from the limitations of the early technologies. Having no functions to ha…
September 2010 Author: ()
Product group: IT platform toolkit

The New JKlustor Suite Presentation

jklustor
JKlustor, ChemAxon’s first package providing capabilities beyond core cheminformatics has been intensively developed in the past few years. Diverse problems ranging form the crude …
September 2009 Author: ()
Product group: Discovery toolkit

A sneak peek at the ChemAxon Registration Service Presentation

regteam
Registration is an important part of any company dealing with chemical compounds. In this presentation, we will describe the features of this upcoming product and display screen shots of …
September 2011 Author: ()
Product group: IT platform toolkit

Markush Structure Usability in Patent and Combinatorial Chemistry: New Approaches and Software Tools Presentation

markush
Markush structures are widely used in combinatorial libraries and patents. However, the flexibility and complexity of Markush structures make them difficult to create, index, visualize, s…
March 2012 Author: ()
Product group: Markush IP

Quicker, better, sketcher Presentation

quickerbetter
Can you sketch the structure of Viagra in half minute? Or even in 5 seconds? This presentation shows you tips and tricks that make sketching easier and faster but might have been hidden f…
September 2010 Author: ()
Product group: Desktop applications

Twenty ten, a year of JChem Presentation

yearofjchem
The back-end (chemical engine) products of ChemAxon will be introduced with special focus on latest developments. JChem Base is a chemical database management toolkit to handle molecules,…
September 2010 Author: ()
Product group: IT platform toolkit

Naming and chemicalize.org Presentation

naming
We will present improvements in our name to structure and structure to name tools. We also demonstrate the extraction of chemical structure from their names occurring in text documents, w…

ChemAxon SharePoint Technologies Presentation

sharepoint
Microsoft SharePoint Server is becoming the standard portal platform at most major pharmaceutical companies. It lets scientists to easily share and manage research and discovery data. Mo…
September 2010 Author: ()
Product group: IT platform toolkit

Instant JChem ‐ more ways to see your data Presentation

ijc
Instant JChem 5.4 included many new ways to view and work with data. New form widgets provide ways to generate information rich forms, and to visualise data graphically, and interact with…
September 2011 Author: ()
Product group: Desktop applications

Instant JChem as a tool for rapid creation and deployment of chemistry databases Presentation

timijc
We provide examples of how a chemistry database can easily be created and deployed to users using Instant JChem. This will illustrate how the database can be built and incorporated into I…
May 2010 Author: ()
Product group: Desktop applications
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