Search Results

There are 2777624 results for: content related to: Correlations between Chemical Structures and NMR Data

  1. Web-Based Calculation of Molecular Properties

    Handbook of Chemoinformatics: From Data to Knowledge in 4 Volumes

    Peter Ertl, Paul Selzer, Pages: 1336–1348, 2008

    Published Online : 5 MAY 2008, DOI: 10.1002/9783527618279.ch42a

  2. Chemoinformatics applications of cluster analysis

    Wiley Interdisciplinary Reviews: Computational Molecular Science

    Volume 4, Issue 1, January/February 2014, Pages: 34–48, John David MacCuish and Norah Elizabeth MacCuish

    Version of Record online : 20 MAY 2013, DOI: 10.1002/wcms.1152

  3. Similarity methods in chemoinformatics

    Annual Review of Information Science and Technology

    Volume 43, Issue 1, 2009, Pages: 1–117, Peter Willett

    Version of Record online : 16 FEB 2011, DOI: 10.1002/aris.2009.1440430108

  4. A History of Chemoinformatics

    Handbook of Chemoinformatics: From Data to Knowledge in 4 Volumes

    Johann Gasteiger, Pages: 6–20, 2008

    Published Online : 5 MAY 2008, DOI: 10.1002/9783527618279.ch2

  5. Algorithmic Chemoinformatics

    Tutorials in Chemoinformatics

    Martin Vogt, Antonio Vega de Leon, Jürgen Bajorath, Pages: 393–448, 2017

    Published Online : 23 JUN 2017, DOI: 10.1002/9781119161110.ch24

  6. Chemoinformatics and the Quest for Leads in Drug Discovery

    Handbook of Chemoinformatics: From Data to Knowledge in 4 Volumes

    Johann Gasteiger, Pages: 1508–1531, 2008

    Published Online : 5 MAY 2008, DOI: 10.1002/9783527618279.ch44b

  7. The Scope of Chemoinformatics

    Handbook of Chemoinformatics: From Data to Knowledge in 4 Volumes

    Johann Gasteiger, Pages: 3–5, 2008

    Published Online : 5 MAY 2008, DOI: 10.1002/9783527618279.ch1

  8. Future Directions

    Handbook of Chemoinformatics: From Data to Knowledge in 4 Volumes

    Johann Gasteiger, Pages: 1845–1848, 2008

    Published Online : 5 MAY 2008, DOI: 10.1002/9783527618279.ch46

  9. Chemoinformatic Tools for Library Design and the Hit-to-Lead Process: A User's Perspective

    Chemoinformatics in Drug Discovery

    Robert Alan Goodnow, Paul Gillespie, Konrad Bleicher, Pages: 381–435, 2005

    Published Online : 19 MAY 2005, DOI: 10.1002/3527603743.ch15

  10. XML and Its Application in Chemistry

    Handbook of Chemoinformatics: From Data to Knowledge in 4 Volumes

    Peter Murray-Rust, Henry S. Rzepa, Pages: 466–486, 2008

    Published Online : 5 MAY 2008, DOI: 10.1002/9783527618279.ch16

  11. Chemoinformatics: a history

    Wiley Interdisciplinary Reviews: Computational Molecular Science

    Volume 1, Issue 1, January/February 2011, Pages: 46–56, Peter Willett

    Version of Record online : 21 JAN 2011, DOI: 10.1002/wcms.1

  12. Introduction

    Chemoinformatics: A Textbook

    Johann Gasteiger, Thomas Engel, Pages: 1–13, 2004

    Published Online : 23 MAR 2004, DOI: 10.1002/3527601643.ch1

  13. You have free access to this content
    Representation of Chemical Compounds

    Handbook of Chemoinformatics: From Data to Knowledge in 4 Volumes

    Johann Gasteiger, Pages: 21–26, 2008

    Published Online : 5 MAY 2008, DOI: 10.1002/9783527618279.part2

  14. You have free access to this content
    Searching Chemical Structures

    Handbook of Chemoinformatics: From Data to Knowledge in 4 Volumes

    Johann Gasteiger, Pages: 865–867, 2008

    Published Online : 5 MAY 2008, DOI: 10.1002/9783527618279.part6

  15. Chemoinformatic Characterization of the Chemical Space and Molecular Diversity of Compound Libraries

    Diversity-Oriented Synthesis: Basics and Applications in Organic Synthesis, Drug Discovery, and Chemical Biology

    Andrea Trabocchi, Pages: 325–352, 2013

    Published Online : 21 JUN 2013, DOI: 10.1002/9781118618110.ch10

  16. Chemoinformatic Tools for High-throughput Screening Data Analysis

    High-Throughput Screening in Drug Discovery, Volume 35

    Peter G. Nell, Stefan M. Mundt, Pages: 207–257, 2006

    Published Online : 5 OCT 2006, DOI: 10.1002/9783527609321.ch8

  17. Solved and Unsolved Problems of Chemoinformatics

    Molecular Informatics

    Volume 33, Issue 6-7, June 2014, Pages: 454–457, Johann Gasteiger

    Version of Record online : 6 JUN 2014, DOI: 10.1002/minf.201400068

  18. Combinatorics of Organic Molecular Structures

    Handbook of Chemoinformatics: From Data to Knowledge in 4 Volumes

    Johann Gasteiger, Pages: 195–205, 2008

    Published Online : 5 MAY 2008, DOI: 10.1002/9783527618279.ch7d

  19. Chemoinformatics and chemical genomics: potential utility of in silico methods

    Journal of Applied Toxicology

    Volume 32, Issue 11, November 2012, Pages: 880–889, Luis G. Valerio Jr and Supratim Choudhuri

    Version of Record online : 10 AUG 2012, DOI: 10.1002/jat.2804

  20. You have free access to this content
    Introduction

    Handbook of Chemoinformatics: From Data to Knowledge in 4 Volumes

    Johann Gasteiger, Pages: 1–2, 2008

    Published Online : 5 MAY 2008, DOI: 10.1002/9783527618279.part1