1. Open Computing Grid for Molecular Sciences

  1. El-Ghazali Talbi3 and
  2. Albert Y. Zomaya4
  1. Mathilde Romberg1,
  2. Emilio Benfenati2 and
  3. Werner Dubitzky1

Published Online: 30 APR 2007

DOI: 10.1002/9780470191637.ch1

Grid Computing for Bioinformatics and Computational Biology

Grid Computing for Bioinformatics and Computational Biology

How to Cite

Romberg, M., Benfenati, E. and Dubitzky, W. (2007) Open Computing Grid for Molecular Sciences, in Grid Computing for Bioinformatics and Computational Biology (eds E.-G. Talbi and A. Y. Zomaya), John Wiley & Sons, Inc., Hoboken, NJ, USA. doi: 10.1002/9780470191637.ch1

Editor Information

  1. 3

    LIFL, University of Lille, INRIA, CNRS, Lille, France

  2. 4

    School of Information Technology, University of Sydney, Sydney, Australia

Author Information

  1. 1

    School of Biomedical Sciences, University of Ulster, Coleraine, United Kingdom

  2. 2

    Mario Negri Institute of Pharmaceutical Research, Milano, Italy

Publication History

  1. Published Online: 30 APR 2007
  2. Published Print: 3 DEC 2007

ISBN Information

Print ISBN: 9780471784098

Online ISBN: 9780470191637

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Keywords:

  • substances of very high concern (SVHC);
  • quantitative structure–activity relationship (QSAR) or quantitative structure–property relationship (QSPR);
  • multilinear regression (MLR), partial least squares (PLS), or artificial neural networks (ANNs)

Summary

This chapter contains sections titled:

  • Introduction

  • Grids for Toxicology and Drug Discovery

  • Example OpenMolGRID

  • Summary and Outlook

  • Acknowledgments

  • References