International Journal of Quantum Chemistry

Cover image for International Journal of Quantum Chemistry

Supplement: Proceedings of the International Symposium on Quantum Biology and Quantum Pharmacology

5/7 March 1981

Volume 20, Issue S8

Pages fmi–fmi, vii–vii, 1–482

  1. Masthead

    1. Top of page
    2. Masthead
    3. Introduction
    4. Articles
    5. Abstracts
    1. Masthead (page fmi)

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200701

  2. Introduction

    1. Top of page
    2. Masthead
    3. Introduction
    4. Articles
    5. Abstracts
    1. You have free access to this content
      Introduction (page vii)

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200702

  3. Articles

    1. Top of page
    2. Masthead
    3. Introduction
    4. Articles
    5. Abstracts
    1. Development of a flexible intra- and intermolecular empirical potential function for large molecular systems (pages 1–47)

      Tetsuro Oie, Gerald M. Maggiora, Ralph E. Christoffersen and David J. Duchamp

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200703

    2. Ab-initio calculations of charge transfer interactions involving ascorbic acid and its metabolites (pages 81–93)

      Patricia R. Laurence and Colin Thomson

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200707

    3. Quantum chemical studies of aflatoxins: Metabolism and carcinogenic activity (pages 95–107)

      Gilda H. Loew and Michael T. Poulsen

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200708

    4. A theoretical study of the selective alkali and alkaline-earth cation binding properties of valinomycin (pages 109–116)

      N. Gresh, C. Etchebest, O. de la Luz Rojas and A. Pullman

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200709

    5. Ab-initio molecular orbital study of the cis/trans conformations of the peptide bond (pages 117–127)

      R. Ramani and Russell J. Boyd

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200710

    6. Molecular orbital studies on nucleoside antibiotics V. Conformation of pyrazofurins (pages 129–138)

      C. L. Chatterjee and Anil Saran

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200711

    7. Implications of aminoacyladenylate conformations in the prebiotic polypeptide synthesis (pages 139–148)

      H. Broch, D. Cabrol and D. Vasilescu

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200712

    8. The electrostatic potential of a model phospholipid monolayer (pages 161–170)

      Krystyna Zakrzewska, Richard Lavery and Bernard Pullman

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200714

    9. Manifold theory of multidimensional potential surfaces (pages 185–196)

      Paul G. Mezey

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200716

    10. Effects of N-protonation on the electronic structure of morphine and naloxone (pages 201–219)

      B. Vernon Cheney and Dominic A. Zichi

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200718

    11. Hydrogen-bonding geometry and patterns in carbohydrates and amino acids (pages 231–239)

      G. A. Jeffrey and H. Maluszynska

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200720

    12. Proton NMR studies of the histidine residues and of bound ATP on rabbit muscle pyruvate kinase (pages 241–245)

      Shunsuke Meshitsuka, Gary M. Smith and Albert S. Mildvan

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200721

    13. NMR probes of the spatial arrangement of substrates at the active site of creatine kinase (pages 247–256)

      Raj K. Gupta and Jeffrey L. Benovic

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200722

    14. 1H nuclear relaxation study of the aniline-binding site in human hemoglobin (pages 257–264)

      Robert P. Sheridan and Raj K. Gupta

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200723

    15. Damping of DNA vibration modes by viscous solvents (pages 271–276)

      L. L. van Zandt

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200725

    16. Structure of DNA oligonucleotides (pages 277–285)

      Belinda J. Wagner, Chanchal K. Mitra and Ramaswamy H. Sarma

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200726

    17. Structural motifs of the nucleotidyl unit and the handedness of polynucleotide helices (pages 287–306)

      M. Sundaralingam and E. Westhof

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200727

    18. Electrical properties of proteins as a function of hydration and NaCl content (pages 307–316)

      Stephen Bone, Joyce Eden and Ronald Pethig

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200728

    19. Hunting of strange electronic states and structures in solids and biopolymers (pages 347–357)

      G. Biczó and I. Lukovits

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200731

    20. Effect of water on the tautomeric equilibrium of 2-oxopyridine. A Monte Carlo simulation study (pages 359–364)

      Victor I. Danilov, Józef S. Kwiatkowski, Bogdan Lesyng and Valery I. Poltev

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200732

    21. The insulin transduction system: A biophysical model for mitogenesis (pages 365–371)

      Richard D. Moore

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200733

    22. Molecular determinants for binding of methylenedioxytryptamines at 5-HT/LSD receptors (pages 373–384)

      Patricia H. Reggio, Harel Weinstein, Roman Osman and Sid Topiol

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200734

    23. Conduction processes of the gramicidin channel (pages 385–399)

      D. W. Urry, C. M. Venkatachalam, K. U. Prasad, R. J. Bradley, G. Parenti-Castelli and G. Lenaz

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200735

    24. Relationships between carcinogenicity, mutagenicity, and theoretical reactivity indices for polycyclic aromatic hydrocarbons (pages 401–408)

      Paul G. Seybold, Richard Vestewig and John D. Scribner

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200736

    25. A comparative analysis of the stability of the chymotrypsin charge triad (pages 409–417)

      Masayuki Shibata, Thomas Kieber-Emmons, Shibani Dutta and Robert Rein

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200737

    26. Origins of the protein synthesis cycle (pages 441–454)

      Sidney W. Fox

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200739

    27. Geometry and evolution (pages 455–461)

      G. L. Findley and S. P. McGlynn

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200740

  4. Abstracts

    1. Top of page
    2. Masthead
    3. Introduction
    4. Articles
    5. Abstracts
    1. Abstracts (pages 481–482)

      Article first published online: 16 APR 2008 | DOI: 10.1002/qua.560200742

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