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Journals in DBLP

Journal of Computational Chemistry
1997, volume: 18, number: 3

  1. Matthias Krack, Andreas M. Köster, Karl Jug
    Approximate molecular electrostatic potentials from semiempirical wavefunctions. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:3, pp:301-312 [Journal]
  2. M. L. Sánchez, Manuel Angel Aguilar Espinosa, Francisco Javier Olivares del Valle
    Study of solvent effects by means of averaged solvent electrostatic potentials obtained from molecular dynamics data. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:3, pp:313-322 [Journal]
  3. Zhiqiang Wang, Ruth Pachter
    Prediction of peptide conformation: The adaptive simulated annealing approach. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:3, pp:323-329 [Journal]
  4. Gábor I. Csonka, Krisztina Éliás, Imre G. Csizmadia
    Ab initio and density functional study of the conformational space of 1C4 ALFA -L-fucose. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:3, pp:330-342 [Journal]
  5. Laurent David, Martin J. Field
    Basis set approach to solution of poisson equation for small molecules immersed in solvent. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:3, pp:343-350 [Journal]
  6. Dino R. Ferro, Paolo Pumilia, Massimo Ragazzi
    An improved force field for conformational analysis of sulfated polysaccharides. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:3, pp:351-367 [Journal]
  7. Konrad Hinsen, Benoît Roux
    A potential function for computer simulation studies of proton transfer in acetylacetone. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:3, pp:368-380 [Journal]
  8. Mario E. Fajardo, Jerry A. Boatz
    Monte Carlo simulations of Na atoms in dynamically disordered Ar systems: Solid, liquid, and critical-point fluid Ar. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:3, pp:381-392 [Journal]
  9. Sergey Vyazovkin
    Evaluation of activation energy of thermally stimulated solid-state reactions under arbitrary variation of temperature. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:3, pp:393-402 [Journal]
  10. Kenneth D. Gibson, Harold A. Scheraga
    Energy minimization of rigid-geometry polypeptides with exactly closed disulfide loops. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:3, pp:403-415 [Journal]
  11. Sergei F. Vyboishchikov, Anibal Sierraalta, Gernot Frenking
    Topological analysis of electron density distribution taken from a pseudopotential calculation. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:3, pp:416-429 [Journal]
  12. Holger Dachsel, Hans Lischka, Ron L. Shepard, Jarek Nieplocha, Robert J. Harrison
    A massively parallel multireference configuration interaction program: The parallel COLUMBUS program. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:3, pp:430-448 [Journal]
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