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Improving usability and accessibility of cheminformatics tools for chemists through cyberinfrastructure and education.

Identifieur interne : 001199 ( Main/Exploration ); précédent : 001198; suivant : 001200

Improving usability and accessibility of cheminformatics tools for chemists through cyberinfrastructure and education.

Auteurs : Rajarshi Guha [États-Unis] ; Gary D. Wiggins ; David J. Wild ; Mu-Hyun Baik ; Marlon E. Pierce And ; Geoffrey C. Fox

Source :

RBID : pubmed:22475751

English descriptors

Abstract

Some of the latest trends in cheminformatics, computation, and the world wide web are reviewed with predictions of how these are likely to impact the field of cheminformatics in the next five years. The vision and some of the work of the Chemical Informatics and Cyberinfrastructure Collaboratory at Indiana University are described, which we base around the core concepts of e-Science and cyberinfrastructure that have proven successful in other fields. Our chemical informatics cyberinfrastructure is realized by building a flexible, generic infrastructure for cheminformatics tools and databases, exporting "best of breed" methods as easily-accessible web APIs for cheminformaticians, scientists, and researchers in other disciplines, and hosting a unique chemical informatics education program aimed at scientists and cheminformatics practitioners in academia and industry.

DOI: 10.3233/CI-2008-0015
PubMed: 22475751


Affiliations:


Links toward previous steps (curation, corpus...)


Le document en format XML

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