Cheminformatics


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The field of chemistry that integrates chemical data with analytic and molecular design tools finding the 'best- fitting' compounds to address particular targets; cheminformatics encompasses diversity analysis and library design, virtual screening, rational drug design, and tools and approaches for predicting activity and other properties from structure
References in periodicals archive ?
NASDAQ: ACCL), a leading provider of enterprise cheminformatics software, announced the addition of Pfizer to the Accelrys Enterprise Cheminformatics Consortium ("Consortium").
Cheminformatics is a computational technique used to predict and reason about chemical properties, while pathway analysis uses computational methods to reason about biological processes such as metabolism.
and ChemAxon, a leading provider of cheminformatics software for the life sciences industry, announce the licensing of ChemAxon's JChem for the Japanese Consortium for Glycobiology and Glycotechnology Database (JCGGDB: http://jcggdb.
Robert Fraczkiewicz, ADMET Predictor software product manager and team leader for ADMET Cheminformatics, said: "The new models we released today predict the ability of potential new drug molecules to interfere with the replication of the human immunodeficiency virus Type 1 (HIV-1) by interfering with an essential enzyme known as HIV integrase.
For the first time ever, R&D end users can search and analyze Thomson Reuters trusted Markush chemical structures and patents with ChemAxon's cheminformatics applications to streamline workflow productivity
Sandy is widely respected throughout the cheminformatics community as a thought leader and a colleague, and he is a most deserving recipient of this award.
2, new releases from its Accord family of cheminformatics products for obtaining maximum value from chemical data and for building configurable chemistry-enabled solutions.
ChemAxon, a software solutions provider for cheminformatics, today announced the launch of JChem for Excel.
David Miller, ClassPharmer software product manager and Team Leader for Discovery Cheminformatics, said: "This version is the result of several months of work.
BUDAPEST, Hungary, January 22 /PRNewswire/ -- ChemAxon - a leading provider of cheminformatics software for the life sciences industry has entered into agreement with Pfizer to provide its Markush searching and structure enumeration functionality for global development and deployment within Pfizer's global R&D facilities.
BUDAPEST, Hungary, April 15 /PRNewswire/ -- ChemAxon, a software solutions provider for cheminformatics today announced the launch of version 5.
Robert Fraczkiewicz, ADMET Predictor product manager and Team Leader for ADMET Cheminformatics for Simulations Plus, said: "This version is the culmination of months of work to integrate ADMET Predictor with the superior modeling capabilities of our ADMET Modeler software.
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