Library

Marvin Live at Vertex Pharmaceuticals Incorporated

Sep 14, 2016 - Presentation
We will describe briefly how Marvin Live is used at Vertex Pharmaceuticals Incorporated. We will share our involvement in the early development of Marvin Live.

Small Molecules in Big Data: Proceed with Caution!

Sep 14, 2016 - Presentation
The Schürer research group at The University of Miami is one of three sites for the Big Data to Knowledge (BD2K) Data Coordination Integration Center (DCIC) of the Library of Integrated …

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…

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…

Marvin JS

Sep 14, 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…

Development of a chemical drawing program that provides scientifically correct and engaging first impression for students

May 25, 2016 - Presentation
The ever-expanding internet access and the mass availability of affordable computers for students provide a new and exciting opportunity for academia. The online education enables scaling…

Chemicalize

Sep 15, 2016 - Presentation
Chemicalize was created as a free, online demonstration and advertising application of ChemAxon’s naming and calculation technologies eight years ago. Currently this is one of the most …

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…
day02_snapshot_Andras_Dancso_02

Two sides of a migration process

May 20, 2015 - Presentation
Egis Pharmaceuticals PLC, Budapest, Hungary, developed a chemical database for 20 years based on at first MDL’s ChemBase then later ISIS/Base. The database included both chemical an…
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Development of web-based Chemistry Design Tools at GlaxoSmithKline

May 20, 2015 - Presentation
At GSK we have a long history of putting design & analysis tools into the hands of medicinal chemists. However, for a variety of reasons, we have found ourselves with a proliferation…
ijcevotec

The challenges of loading chemical supplier catalogues

May 20, 2010 - Presentation
We will describe the “fun” we are having creating rules and workflows to tidy up the data from chemical supplier catalogues for our compound sourcing database.
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
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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
evotttt

Integrating JChem and Marvin with an ELN

May 19, 2010 - Presentation
We will describe how we (well Contur) are using Marvin & Reactor in their ELN and how we are using JChem Cartridge to link it to our compound sourcing database so searches can be don…
day02_snapshot_George_Papadatos_01

SureChEMBL: An Open Patent Chemistry Resource

May 20, 2015 - Presentation
SureChEMBL is a new resource provided by the European Bioinformatics Institute (EMBL-EBI) that annotates, extracts and indexes chemistry from full text patent documents by means of contin…
lilly

SPrime: Computational Chemistry Application and Framework for Drug Discovery

Sep 15, 2009 - Presentation
We have designed SPrime (System for Predictive In-silico Method) – a new computational chemistry application and framework for drug discovery. It enables scientists to design librar…
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