Chemistry & Biodiversity

Copyright © 2012 Verlag Helvetica Chimica Acta AG, Zürich, Switzerland

Cover image for Chemistry & Biodiversity

November 2005

Volume 2, Issue 11

Pages 1409–1594

    1. Contents: C&B 11/2005

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590130

    2. Editorial: Looking to the Future: Computational Methods in Drug Design (pages 1409–1410)

      Neal Castagnoli and Lemont Kier

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590114

    3. Musings on ADME Predictions and Structure–Activity Relations (pages 1411–1427)

      Bernard Testa, Giulio Vistoli and Alessandro Pedretti

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590115

    4. The Prediction of ADMET Properties Using Structure Information Representations (pages 1428–1437)

      Lemont B. Kier and Lowell H. Hall

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590116

    5. Application of 3D-QSAR in the Rational Design of Receptor Ligands and Enzyme Inhibitors (pages 1438–1451)

      Marco Mor, Silvia Rivara, Alessio Lodola, Simone Lorenzi, Fabrizio Bordi, Pier Vincenzo Plazzi, Gilberto Spadoni, Annalida Bedini, Andrea Duranti, Andrea Tontini and Giorgio Tarzia

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590117

    6. Rational Design and Development of Radiation-Sensitizing Histone Deacetylase Inhibitors (pages 1452–1461)

      Mira Jung, Alan Kozikowski and Anatoly Dritschilo

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590118

    7. Development and Application of Physiologically Based Pharmacokinetic-Modeling Tools to Support Drug Discovery (pages 1462–1486)

      Christian Lüpfert and Andreas Reichel

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590119

    8. Analysis and Understanding of High-Dimensionality Data by Means of Multivariate Data Analysis (pages 1487–1494)

      Bo Nordén, Per Broberg, Claes Lindberg and Amelie Plymoth

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590120

    9. A Signature-Based Method to Distinguish Time-Of-Flight Secondary-Ion Mass Spectra from Biological Samples (pages 1495–1502)

      Judy N. Quong, Andrew A. Quong, Kuang Jen Wu and James R. Kercher

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590121

    10. Molecular Simulation Study of the Influence of Small Molecules on the Dynamic and Structural Properties of Phospholipid Bilayers (pages 1503–1516)

      Amadeu K. Sum

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590122

    11. Yucca: An Efficient Algorithm for Small-Molecule Docking (pages 1517–1524)

      Vicky Choi

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590123

    12. Application of Molecular Modeling to Analysis of Inhibition of Kinesin Motor Proteins of the BimC Subfamily by Monastrol and Related Compounds (pages 1525–1532)

      David R. Bevan, James F. Garst, Caroline K. Osborne and Angela M. Sims

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590124

    13. Chemical and Structural Diversity in Cyclooxygenase Protein Active Sites (pages 1533–1552)

      Ryan G. Huff, Ersin Bayram, Huan Tan, Stacy T. Knutson, Michael H. Knaggs, Allen B. Richon, Peter Santago II and Jacquelyn S. Fetrow

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590125

    14. A Three-Dimensional Model of Intercellular Calcium Signaling in Epithelial Cells (pages 1553–1563)

      Judy N. Quong, Aaron J. Golumbfskie, Albert Nichols and Andrew A. Quong

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590126

    15. Identification of Novel Neuroprotective Agents Using Pharmacophore Modeling (pages 1564–1570)

      Alan I. Faden, Vilen A. Movsesyan, Xueliang Fang and Shaomeng Wang

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590127

    16. Methodology for Multi-Site Ligand–Protein Docking Identification Developed for the Optimization of Spirostenol Inhibition of β-Amyloid-Induced Neurotoxicity (pages 1571–1579)

      Gary L. Teper, Laurent Lecanu, Janet Greeson and Vassilios Papadopoulos

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590128

    17. Rationalizing the Solution Properties of Zwitterions by Means of Computational Chemistry (pages 1580–1594)

      Richard D. Gandour

      Article first published online: 23 NOV 2005 | DOI: 10.1002/cbdv.200590129

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