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Journals in DBLP

Journal of Computational Chemistry
2002, volume: 23, number: 15

  1. Meng-Sheng Liao, Steve Scheiner
    Comparative study of metal-porphyrins, -porphyrazines, and -phthalocyanines. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:15, pp:1391-1403 [Journal]
  2. Li Xie, Haiyan Liu
    The treatment of solvation by a generalized Born model and a self-consistent charge-density functional theory-based tight-binding method. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:15, pp:1404-1415 [Journal]
  3. D. Kony, Wolfgang Damm, S. Stoll, Wilfred F. van Gunsteren
    An improved OPLS-AA force field for carbohydrates. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:15, pp:1416-1429 [Journal]
  4. Denis Jacquemin, Benoît Champagne, Jean-Marie André, Erik Deumens, Yngve Öhrn
    Integral algorithm and density matrix integration scheme for ab initio band structure calculations on polymeric systems. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:15, pp:1430-1444 [Journal]
  5. Masahiro Kinoshita, Yoshiki Sugai
    Methodology of predicting approximate shapes and size distribution of micelles: Illustration for simple models. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:15, pp:1445-1455 [Journal]
  6. Jing-Fa Xiao, Ze-Sheng Li, Jing-Yao Liu, Li Sheng, Chia-Chung Sun
    DFT and Ab initio direct dynamics studies on the hydrogen abstraction reactions of chlorine atoms with CH4-nFn (n = 1-3). [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:15, pp:1456-1465 [Journal]
  7. Akihiro Morita
    Water polarizability in condensed phase: Ab initio evaluation by cluster approach. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:15, pp:1466-1471 [Journal]
  8. Shingo Urata, Seiji Tsuzuki, Masuhiro Mikami, Akira Takada, Tadafumi Uchimaru, Akira Sekiya
    Analysis of the intermolecular interaction between CH3OCH3, CF3OCH3, CF3OCF3, and CH4: High level ab initio calculations. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:15, pp:1472-1479 [Journal]
  9. Grant D. Smith, Oleg Borodin, Dmitry Bedrov
    A revised quantum chemistry-based potential for poly(ethylene oxide) and its oligomers in aqueous solution. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:15, pp:1480-1488 [Journal]
  10. Friedrich Biegler-König, Jens Schönbohm
    Update of the AIM2000-Program for atoms in molecules. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:15, pp:1489-1494 [Journal]
  11. Olivier Quinet, Benoît Champagne, Bernard Kirtman
    Analytical TDHF second derivatives of dynamic electronic polarizability with respect to nuclear coordinates. Application to the dynamic ZPVA correction. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2002, v:23, n:15, pp:1495-1496 [Journal]
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