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Reactor – switching on the manual gear Presentation
Enumeration of compound libraries using virtual reactions is a powerful tool in the early phase of drug design. Through selected examples this presentation will highlight the novel featur…
September 2011
Collaborative R&D Presentation
May 2011
Virtual synthesis and metabolism - new development Presentation
ChemAxon’s Reactor technology has recently been integrated in the Instant JChem platform providing an easy to use interface for Combichem library generation in databases. A new appl…
September 2009
Reactor and Metabolizer: in vitro, in vivo and in situ in silico Presentation
ChemAxon developed a unique virtual reaction technology that could be applied in various areas of molecule transformations. Reactor is a virtual combichem application providing synthetica…
August 2008
Introducing, what will be, the Reactor GUI Presentation
ChemAxon’s Reactor technology was well accepted by the cheminformatics experts, but the flexible API and the command line interfaces are not too handy for chemists who are experienc…
June 2006
Product group:
Discovery toolkit
Scientific Workshop, Virtual Library Generation Presentation
Reactor is the primary engine for virtual reaction processing, but it is less known, that the professional edition contains higher level tools for various molecule transformation tasks. P…
June 2006
Reactor latest Presentation
Reactor is virtual synthesis engine able to predict products of given reactions and able to enumerate synthetically feasible combichem libraries. Beside a live demonstration of the core o…
June 2007
Virtual reaction design for chemists Presentation
Library enumeration is a powerful way for the generation libraries containing loads of NON-synthesizable compounds. At least not on that planned synthetic route due to activation/deactiva…
September 2010
Virtual Libraries and Virtual Screening in Drug Discovery Processes using KNIME Presentation
Based around ChemAxon’s discovery tools we will discuss key aspects of virtual high throughput screening methods including management and characterization of virtual libraries, alte…
Command line tools of ChemAxon: tips and tricks Presentation
ChemAxon offers a comprehensive API for programmers accessing all classes and functionalities of the JChem toolkit. Database developers often use SQL statements via the JChem Cartridge fo…
September 2009
KNOWTOX, a Franco-Hungarian collaborative project relative to toxicity Presentation
Drug-induced hepatotoxicity or liver damage/disease is a major concern during the drug development process. Toxicity knowledge exists but data is scattered in numerous sources and can not…
June 2007
The Transformers of ChemAxon Presentation
ChemAxon provides some tools for the transformation of molecules. The overview of these technologies will be followed by the demonstration of Standardizer and Reactor focusing on the new …
May 2008
Chemical Terms, a Language for Cheminformatics Presentation
Flexibility and ease of use are important yet contradicting requirements in cheminformatics systems. Complex search criteria routinely used in database queries provide apparent examples. …
June 2007
In silico synthesis Presentation
Key topics:
Embedding preparative experience in selective virtual reactions
Synthesis based drug discovery and other applications
Reactor API demonstration
Additional Resources
ChemAxo…
May 2005
Product group:
Discovery toolkit
Modelling experiments using Teranode XDA and ChemAxon Presentation
Managing experimentation from across discovery requires information systems that can deal with heterogeneous data collected from various disciplines. Each research area requires its own o…
June 2006
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