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Journals in DBLP

Journal of Computational Chemistry
2001, volume: 22, number: 15

  1. Miroslav Pinak
    Molecular dynamics simulation of thymine glycol-lesioned DNA reveals specific hydration at the lesion. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2001, v:22, n:15, pp:1723-1731 [Journal]
  2. Aldo Jongejan, Jaap A. Jongejan, Wilfred R. Hagen
    Direct hydride transfer in the reaction mechanism of quinoprotein alcohol dehydrogenases: a quantum mechanical investigation. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2001, v:22, n:15, pp:1732-1749 [Journal]
  3. Yuan-Ping Pang, Emanuele Perola, Kun Xu, Franklyn G. Prendergast
    EUDOC: a computer program for identification of drug interaction sites in macromolecules and drug leads from chemical databases. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2001, v:22, n:15, pp:1750-1771 [Journal]
  4. Tatyana Kuznetsova, Bjôrn Kvamme
    Viabilty of atomistic potentials for thermodynamic properties of carbon dioxide at low temperatures. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2001, v:22, n:15, pp:1772-1781 [Journal]
  5. Carl S. Ewig, Rajiv Berry, Uri Dinur, Jörg-Rüdiger Hill, Ming-Jing Hwang, Haiying Li, Chris Liang, Jon Maple, Zhengwei Peng, Thomas P. Stockfisch, Thomas S. Thacher, Lisa Yan, Xiangshan Ni, Arnold T. Hagler
    Derivation of class II force fields. VIII. Derivation of a general quantum mechanical force field for organic compounds. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2001, v:22, n:15, pp:1782-1800 [Journal]
  6. Wolfgang Kliesch
    EQUIPATH - an equilibrial path tracing routine for the use with the program package GAUSSIAN94. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2001, v:22, n:15, pp:1801-1816 [Journal]
  7. Odonírio Abrahão-Júnior, Paulo G. B. D. Nascimento, Sérgio E. Galembeck
    Conformational analysis of the HIV-1 virus reverse transcriptase nonnucleoside inhibitors: TIBO and nevirapine. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2001, v:22, n:15, pp:1817-1829 [Journal]
  8. Federico Fogolari, G. Esposito, P. Viglino, Henriette Molinari
    Molecular mechanics and dynamics of biomolecules using a solvent continuum model. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2001, v:22, n:15, pp:1830-1842 [Journal]
  9. Xiaoliang Qian, Daniel Strahs, Tamar Schlick
    A new program for optimizing periodic boundary models of solvated biomolecules (PBCAID). [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2001, v:22, n:15, pp:1843-1850 [Journal]
  10. Eduardo J. Delgado, Joel B. Alderete
    Prediction of infinite dilution activity coefficients of chlorinated organic compounds in aqueous solution from quantum-chemical descriptors. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2001, v:22, n:15, pp:1851-1856 [Journal]
  11. Michael Schaefer, Christian Bartels, Fabrice Leclerc, Martin Karplus
    Effective atom volumes for implicit solvent models: comparison between Voronoi volumes and minimum fluctuation volumes. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2001, v:22, n:15, pp:1857-1879 [Journal]
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