Library

Structure and Reaction Querying in Reaxys – A Short History

Apr 11, 2017 - Presentation
Structure and reaction searching is one of Reaxys’ key strengths, which can only be fully exploited with a powerful, yet easy to use structured query editor. This talk will discuss how …

ChemAxon at Merck

May 10, 2017 - Presentation
Merck is at the end of the migration to a new foundation technology for NCEs (Cartridge, Drawing tool and Office-AddOn). The decision was made to go with ChemAxon Technology (Cartridge, M…

Migrating the eMolecules Chemical Search Engine to ChemAxon Technology

Apr 11, 2017 - Presentation
A publicly accessible web site such as emolecules.com, which offers free searching of over ten million commercially available chemical compounds, presents unique technical challenges to R…

Fast access to chemical data with ChemCurator

May 11, 2017 - Presentation
Chemical structures (of organic compounds) are the basis of the language of chemistry. For those who understand it, it conveys lots of information in terms of molecular and bulk propertie…

The Web Wide Chemical Editor

Sep 8, 2017 - Poster
ChemAxon’s Marvin JS adds chemical drawing capabilities to web pages. The tool handles small molecules, reactions, Markush structures and query molecules. Building on 20 years of experi…

European Lead Factory Web Portal

May 11, 2017 - Presentation
The European Lead Factory is an EU-led initiative, part of the IMI program, involving pharmaceutical companies, academic organizations, contract research organizations and public bodies t…
capture

Escape from 'availability bias' in compound design

Jun 12, 2017 - Poster
Small molecule design is an information demanding activity, since all relevant knowledge is to be accessible within a single space and requires synchronized application of computational m…

ChemAxon MarvinJS sketcher integration in Discngine Decision

May 10, 2017 - Presentation
Discngine Decision is a scientific support platform used to combine and interpret experimental results and speed up decision-making processes. Discngine Decision can gather and analyze da…

Chemical Weapons

Apr 1, 2014 - Publication
One of the most important business management challenges for chemistry departments in the global life sciences industry is dealing with controlled substance compliance. Controlled substan…

From Library Design to Compound Delivery – Data Managment in a CRO Perspective

May 11, 2017 - Presentation
Data management and the seamless support of the design-production workflows play a key role in the life of a CRO company. No matter if it is about building blocks, libraries, off-the-shel…

Data Mining Small Molecule Drug Discovery

May 10, 2017 - Presentation
Despite having more information and technology than at any point in history, drug discovery is becoming harder. It is tempting to believe that there was ‘low hanging fruit’ in the pas…

ChemAxon Integration to Questel Tools

May 11, 2017 - Presentation
Presentation of chemistry search with Orbit patent database and IP landscape tool specific to chemistry fields.

Meeting the ever-changing demands of synthetic chemistry - A chemical workbench for biopolymers

Apr 11, 2017 - Presentation
The in-silico tools and resources for a Design-Make-Test paradigm in small molecule chemistry have significantly advanced in the last half decade. We are nearing a point in time where a c…
Product group: IT platform toolkit

An Online Integrated Testing Strategy Development for Skin Sensation Assessment

May 10, 2017 - Presentation
Allergic contact dermatitis (aka., skin sensitization) accounts for 20% of all contact dermatitis cases and hence has an estimated annual cost up to $200 million. It is also a public heal…

Compliance Checker

Sep 14, 2016 - Presentation
Compliance Checker is a combined software system and content package providing a way to check whether your compounds are controlled according to the relevant laws of the countries of inte…

Plexus Suite and Instant JChem

Apr 11, 2017 - Presentation
Instant JChem is a desktop application designed for researchers and can be considered as a predecessor of the emerging Plexus Suite. Instant JChem allows you to create, explore, and share…

Does a 3D shape based method differ from a molecular descriptor based similarity in its ability to predict biological activity?

May 10, 2017 - Presentation
Similarity of molecular structures is data-set dependent. The DTP’s NC60 panel is a collection of 60 cancerous cell lines maintained by the National Cancer Institute (NCI). Since 1990 t…

Compliance Checker

May 10, 2017 - Presentation
Compliance Checker is a combined software system and content package providing a way to check whether your compounds are controlled according to the laws of the countries of interest. Thi…

Fast similarity searching – making the virtual real

May 24, 2016 - Presentation
Similarity searching is a key component of many chemoinformatic processes including compound collection design, compound clustering and lead hopping. We have command-line tools for bespok…

Finland's national matriculation exams go electronic

May 10, 2017 - Presentation
Finnish matriculation examination is the easiest way to apply to the universities. The students usually take the test on their 12th school year. Since 2016 the exam has been carried out e…
1234567>