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…
jinling sui

Building the Bioinformatic Platform for Drug Discovery at Flatley Discovery Lab

Sep 26, 2014 - Presentation
Building a suitable bioinformatic platform for small molecule R&D with high throughput screening (HTS) is challenging for a small biotech startup with limited experiences and resourc…
Product group: IT platform toolkit
J. Zane Barlow

Marvin JS goes to College

Sep 26, 2014 - Presentation
Marvin JS is a novel light-weight chemical editor suitable for generating standard chemical structures without the need for installing Java, designed by ChemAxon. It provides all the ess…
01_Ian_Berry

Keynote

May 20, 2014 - Presentation
ChemAxon’s user group meeting (UGM) in 2014, Budapest started with a keynote, a talk between our CEO, Alex Drijver and Ian Berry, Manager, Informatics at Evotec, a contract research…
john b. Kinney

Improving The Effectiveness Of Our R&D Organizations Through Incrementally-Enhanced Informatics

Sep 26, 2014 - Presentation
A typical life science researcher is expected to wear many hats, project manager, project progenitor, and of course, experimentalist. Computers and informatics systems have come to have a…
Product group: IT platform toolkit

Tuning hERG Out: Antitarget QSAR Models for Drug Development

Feb 11, 2014 - Publication
Several non-cardiovascular drugs have been withdrawn from the market due to their inhibition of hERG K+ channels that can potentially lead to severe heart arrhythmia and death. As hERG sa…
novartisprez

Building on the Instant JChem platform at NIBR

May 20, 2014 - Presentation
Instant JChem (IJC) was first introduced at NIBR as a replacement for a number of legacy applications. Driven by the very positive response from our chemistry community, we have fully int…
edmund taylo

CzeekD: Fragment-based de novo Drug Design System for Drug Discovery

Sep 26, 2014 - Presentation
It has been estimated that there is an enormous number of compounds that consist the vast chemical space and as such, the use of an optimal method to search for novel active compounds is …
zhengwei peng

Construction of a vast virtual chemical space powered by ChemAxon’s Markush Search Platform and its utility in molecular design

Sep 26, 2014 - Presentation
With the addition of a molecular similarity search capability, the ChemAxon Markush Search platform is now capable of performing Exact, Sub-Structure, and Similarity searches. Those three…
Author: ()
Product group: Markush IP
kevin clark

Searching Project Team Documents with D2DB

Sep 26, 2014 - Presentation
At Genentech as in many other biotechnology and pharmaceutical companies, therapeutic project teams generate many documents during the course of a project. These documents contain valuab…
gregory landrum

What else can you do with the Markush cartridge? Tracking chemical series for project teams.

Sep 26, 2014 - Presentation
In a collaboration with ChemAxon we have developed a web-based interface for searching, browsing and managing chemical information. The system was designed to accommodate to capture the i…
bi1

Large and smaller - how to approach a relationship to get the best results

May 20, 2014 - Presentation
Two partners: ChemAxon and Boehringer Ingelheim One goal: Migrating the ISIS platform to ChemAxon tools And 1000 differences The decision to migrate to ChemAxon doesn’t just include…
xin zhang

A chemistry friendly system integrating drug design tools and a consistent visual interface

Sep 26, 2014 - Presentation
Drug discovery today is challenging with metabolism and toxicity playing key roles. Here we present a web based system created at Cubist to allows scientist to use QSAR models and other c…
Author: ()
Product group: Desktop applications
gerald wyckoff

Development of the Chemalytics Platform for Drug Discovery

Sep 26, 2014 - Presentation
Structure-based virtual screening is an important tool in the drug discovery process. The use of computational tools has allowed for the screening of large libraries of chemical compounds…
dana vanderwall

Instant JChem - enabling new ways of working with data and access to new data to work with

Sep 25, 2014 - Presentation
The introduction of Instant JChem and underlying ChemAxon technologies, along with a new data infrastructure designed with analytics in mind, has provided a platform with significantly mo…
brett hiemenz

From Desktop to Browser: ChemAxon Plexus in GlaxoSmithKline

Sep 25, 2014 - Presentation
Since its initial adoption of ChemAxon tools in 2009, GlaxoSmithKline has followed a roadmap moving from desktop tools to web-based enterprise solutions. This presentation will touch on p…
zhenbin li

Challenges and Approach in Migration of Chemistry Infrastructure for Systems and Applications

Sep 25, 2014 - Presentation
Chemistry infrastructure serves as a backbone of pharmaceutical discovery informatics. In last two year, we have implemented and migrated most of our applications and systems using ChemAx…
zhengwei peng

The needs and challenges related to in-depth analysis of patent molecular spaces to support drug discovery projects

Sep 26, 2014 - Presentation
In the course of small-molecule drug discovery projects, there are multiple use cases where in-depth analysis of patent molecular spaces is desirable. This talk will cover several main us…
Author: ()
Product groups: Markush IP, Naming
aptuit2

Expanding the scope of “literature data” with document to structure tools

May 21, 2014 - Presentation
Data associated to chemical structures reported in literature are very important in drug design as they expand the scope of in-house generated knowledge. Public and commercially available…
Product group: Naming
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