Library

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…

ChemAxon European Annual Meeting (UGM), Budapest, May 24-26, 2016

May 24, 2016 - Report
and from command line. The vendor library was prepared as follows. MolConverter was used to generate SMILES from vendor SDfiles and the records from all vendors were merged into one datab…

Questel partners with ChemAxon

May 24, 2016 - Presentation
A partnership was recently signed between ChemAxon and Questel. The outcome of such partnership has already lead to a new product released this month on the Intellixir platform. With furt…

Instant JChem in virtual high throughput screening and commercial compounds selection

May 25, 2016 - Presentation
Search for potential hit compounds using commercially available compound libraries is an important step in the early stage of drug discovery process. An in-house database of commercial co…

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…

Using Plexus Design to create chemical space for structure-based drug design

May 25, 2016 - Presentation
How to make better molecules faster is a key challenge in preclinical drug discovery. At Sprint Bioscience we use fragment-based techniques to quickly find high-quality chemical starting …

Rollout of Plexus Connect at GSK, a brief history and update

May 25, 2016 - Presentation
The Instant JChem (IJC) application is a thick client that has been delivered via a desktop application at GSK. The client uses direct connections to the GSK database infrastructure to …

Plexus Suite

May 24, 2016 - Presentation
Plexus Suite delivers intuitive and easy-to-use cheminformatics solutions to life sciences team members, specially focusing on chemists and biologists for pharmaceutical research. A singl…

MarvinSketch in publication

May 25, 2016 - Presentation
MarvinSketch allows users to quickly draw molecules through basic functions on the GUI to advanced functionalities. This talk will focus to the many useful features added to help the chem…

Instant JChem & Plexus Connect

May 25, 2016 - Presentation
Instant JChem is a desktop application designed for the chemist. With Instant JChem you can create, explore and share chemical and non-chemical data in local and remote databases without …

Biomolecule Toolkit

May 24, 2016 - Presentation
ChemAxon’s Biomolecule Toolkit is a webservice-based toolkit to bridge the gap between biology and chemistry for complex biomolecular entities. It provides unambiguous representation at…
Product group: IT platform toolkit

Marvin Live

May 25, 2016 - Presentation
Drug discovery teams are increasingly spread out over the world and involve CROs or consultants. Circulating ideas within such a team is cumbersome with regular tools. Marvin Live is desi…

JChem for SharePoint & ChemLocator

May 25, 2016 - Presentation
This presentation will focus on a user story where the core problem is to find relevant chemical data in different company databases and inventories. The problem gets even more complicate…

Efficient Heuristics for Maximum Common Substructure Search

Apr 11, 2015 - Publication
Maximum common substructure search is a computationally hard optimization problem with diverse applications in the field of cheminformatics, including similarity search, lead optimization…

Plexus Analysis

May 25, 2016 - Presentation
Plexus Analysis is a web-based data visualization and analytics software for all industries. It can receive data from Plexus Connect tables, from files and through its web service interfa…

ChemCurator

May 24, 2016 - Presentation
ChemCurator is a desktop application to extract chemical information including compounds, Markush structures and related assay data from English, Chinese and Japanese patents, journal art…
Product group: Markush IP

JChem for Office

May 25, 2016 - Presentation
JChem for Office integrates chemical structure handling and visualizing capabilities within a Microsoft Office environment. This presentation will show how JChem for Office enhances the a…

ChemAxon's MadFast Search

May 24, 2016 - Presentation
MadFast is an ongoing development effort to provide useful tools for similarity based search, overlap analysis and clustering. I would like to give a short introduction on the current sta…

Marvin JS

May 25, 2016 - Presentation
Marvin JS is ChemAxon’s chemical editor web component designed for the wider community. It provides a clean, smart user-oriented interface for quick and convenient drawing of chemical s…

Chemical search and database technologies

May 24, 2016 - Presentation
ChemAxon’s search and database technology includes our JChem Base tool and two cartridges: One running on Oracle, the other one on PostgreSQL. We usually refer to these products as …
Product group: IT platform toolkit
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