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Original Articles

Molecular modelling of liquid crystal systems: An internal coordinate Monte Carlo approach

Pages 437-447 | Received 09 Aug 1995, Accepted 12 Apr 1996, Published online: 24 Sep 2006

References

  • Boyd , D. B. 1990 . Reviews in Computational Chemistry , Edited by: Lipkowitz , K. B. and Boyd , D. B. New York : VCH . Chap. 9.
  • Allinger , N. L. 1976 . Rev. phys. org. Chem. , 13 : 1
  • Burkert , O. and Allinger , N. L. 1982 . ACS Monograph , 177 Washington : American Chemical Society .
  • Boyd , D. B. and Lipkowitz , K. B. 1982 . J. chem. Education , 59 : 269
  • Wilson , M. R. 1988 . PhD. thesis University of Sheffield . Chap. 1.
  • 1992 . Interactive Molecular Modelling System , New York : Department of Chemistry, Columbia University . MacroModel V3.5X
  • Quantum Chemistry Program Exchange 423, 1980, MM2: Molecular Mechanics II (CDC Version of QCPE 395), modified by S. Profeta Jr. from the original program by N. L. Allinger and Y. H. Yuh.
  • Stewart , J. J. P. 1990 . J. Comput. Aided Molec. Design , 4 : 1
  • Dunmur , D. A. , Grayson , M. and Roy , S. K. 1994 . Liq. Cryst. , 16 : 95
  • Allen , M. P. and Tildesley , D. J. 1987 . Computer Simulation of Liquids , Oxford : Oxford University Press .
  • van Gunsteren , W. F. and Berendsen , H. J. C. 1988 . Molec. Simulation , 1 : 173
  • Guarnieri , F. and Still , W. C. 1994 . J. comput. Chem. , 15 : 1302
  • Clark , T. 1985 . A Handbook of Computational Chemistry: A Practical Guide to Chemical Structure and Energy Calculations , New York : Wiley-Interscience . Chap. 3 and Appendix A.
  • Singh , U. C. , Weiner , P. K. , Caldwell , J. and Kollman , P. A. 1987 . AMBER 3.0 , University of California .
  • Weiner , S. J. , Kollman , P. A. , Nguyen , D. T. and Case , D. A. 1986 . J. Comput. Chem. , 7 : 230
  • Weiner , S. J. , Kollman , P. A. , Case , D. A. , Singh , U. C. , Ghio , C. , Alagona , G. , Profeta , S. and Weiner , P. 1984 . J. Am. chem. Soc. , 106 : 765
  • Allinger , N. L. and Sprague , J. P. 1973 . J. Am. chem. Soc. , 95 : 3893
  • Kao , J. and Allinger , N. L. 1977 . J. Am. chem. Soc. , 99 : 975
  • Wilson , M. R. 1988 . PhD. thesis University of Sheffield . Chap. 3.
  • Chandrasekhar , J. and Jorgensen , W. L. 1982 . J. chem. Phys. , 77 : 5073
  • Leggetter , S. and Tildesley , D. J. 1989 . Molec. Phys. , 68 : 519
  • Wilson , M. R. and Allen , M. P. 1992 . Liq. Cryst. , 12 : 157
  • Flory , P. J. 1969 . Statistical Mechanics of Chain Molecules , New York : Interscience .
  • Emsley , J. W. , Luckhurst , G. R. and Stockley , C. P. 1982 . Proc. R. Soc. Lond. A. , 381 : 139
  • Luckhurst , G. R. 1985 . Nuclear Magnetic Resonance of Liquid Crystals , Edited by: Emsley , J. W. Dordrecht : D. Reidel . Chap. 3.
  • Wojtowicz , P. J. 1979 . Introduction to Liquid Crystals , Edited by: Priestley , E. B. , Wojtowicz , P. J. and Sheng , P. New York : Plenum Press . Chap. 3.
  • Vesely , F. J. 1982 . J. comput. Phys. , 47 : 291
  • Wilson , M. R. and Allen , M. P. 1991 . Molec. Cryst. liq. Cryst. , 198 : 465
  • Cross , C. W. and Fung , B. M. 1994 . J. chem. Phys. , 101 : 6839
  • Komolkin , A. V. , Laaksonen , A. and Maliniak , A. 1994 . J. chem. Phys. , 101 : 4103
  • Samulski , E. T. and Dong , R. 1982 . J. chem. Phys. , 77 : 5090
  • Emsley , J. W. , Luckhurst , G. R. and Stockley , C. P. 1981 . Molec. Phys. , 44 : 565
  • Ferrarini , A. , Luckhurst , G. R. and Nordio , P. L. 1995 . Molec. Phys. , 85 : 131
  • Counsell , C. J. R. , Emsley , J. W. , Heaton , N. J. and Luckhurst , G. R. 1985 . Molec. Phys. , 54 : 847
  • Ferrarini , A. , Moro , G. J. , Nordio , P. L. and Luckhurst , G. R. 1992 . Molec. Phys. , 77 : 1

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