Molecular Informatics

Cover image for Vol. 31 Issue 9

September 2012

Volume 31, Issue 9

Pages 613–685

  1. Cover Picture

    1. Top of page
    2. Cover Picture
    3. Editorial
    4. Graphical Abstract
    5. Methods Corner
    6. Communications
    7. Full Papers
    1. You have free access to this content
      Cover Picture: (Mol. Inf. 9/2012) (page 613)

      Version of Record online: 13 SEP 2012 | DOI: 10.1002/minf.201290013

      Thumbnail image of graphical abstract

      Molecular Informatics publishes research that will deepen our understanding about information storage and processing on the molecular level, signaling and regulation of biological and chemical systems including cellular systems and macromolecular assemblies, modeling of molecular interactions and networks, and the design of molecular modulators that exhibit desired biochemical and pharmacological effects. Various aspects of this transdisciplinary scientific area are depicted on the cover: Cells with their nuclei and membranes (image courtesy of Dr. A. Schreiner and E. Resch), models of receptor-ligand interactions, and an artistic representation of “biological information” as multiple bit-codes presented on a right-handed helix.

  2. Editorial

    1. Top of page
    2. Cover Picture
    3. Editorial
    4. Graphical Abstract
    5. Methods Corner
    6. Communications
    7. Full Papers
    1. You have free access to this content
      Editorial: Molecular Informatics Gaining Impact (page 615)

      Knut Baumann, Gerhard F. Ecker, Jordi Mestres and Gisbert Schneider

      Version of Record online: 13 SEP 2012 | DOI: 10.1002/minf.201280931

  3. Graphical Abstract

    1. Top of page
    2. Cover Picture
    3. Editorial
    4. Graphical Abstract
    5. Methods Corner
    6. Communications
    7. Full Papers
  4. Methods Corner

    1. Top of page
    2. Cover Picture
    3. Editorial
    4. Graphical Abstract
    5. Methods Corner
    6. Communications
    7. Full Papers
  5. Communications

    1. Top of page
    2. Cover Picture
    3. Editorial
    4. Graphical Abstract
    5. Methods Corner
    6. Communications
    7. Full Papers
    1. Impact of X-Ray Structure on Predictivity of Scoring Functions: PPARγ Case Study (pages 631–633)

      Julia Weber, Matthias Rupp and Ewgenij Proschak

      Version of Record online: 23 AUG 2012 | DOI: 10.1002/minf.201200040

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    2. Homology Modeling and Validation of the Human M1 Muscarinic Acetylcholine Receptor (pages 635–638)

      Balázs Jójárt, Agneta M. Balint, Stefan Balint and Béla Viskolcz

      Version of Record online: 7 SEP 2012 | DOI: 10.1002/minf.201200062

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    3. Interpretability of SAR/QSAR Models of any Complexity by Atomic Contributions (pages 639–642)

      G. Marcou, D. Horvath, V. Solov'ev, A. Arrault, P. Vayer and A. Varnek

      Version of Record online: 21 AUG 2012 | DOI: 10.1002/minf.201100136

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  6. Full Papers

    1. Top of page
    2. Cover Picture
    3. Editorial
    4. Graphical Abstract
    5. Methods Corner
    6. Communications
    7. Full Papers
    1. Harnessing Human N-type Ca2+ Channel Receptor by Identifying the Atomic Hotspot Regions for Its Structure-Based Blocker Design (pages 643–657)

      Ashish Pandey, Jigneshkumar P, Satyaprakash Tripathi and C. Gopi Mohan

      Version of Record online: 7 SEP 2012 | DOI: 10.1002/minf.201200025

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    2. QSAR Modelling of CYP3A4 Inhibition as a Screening Tool in the Context of Drug[BOND]Drug Interaction Studies (pages 669–677)

      Véronique Hamon, Dragos Horvath, Cédric Gaudin, Julie Desrivot, Céline Junges, Alban Arrault, Marc Bertrand and Philippe Vayer

      Version of Record online: 7 SEP 2012 | DOI: 10.1002/minf.201200004

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    3. Probability Based hERG Blocker Classifiers (pages 679–685)

      Zhi Wang, Hamse Y. Mussa, Robert Lowe, Robert C. Glen and Aixia Yan

      Version of Record online: 7 SEP 2012 | DOI: 10.1002/minf.201200011

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