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Journals in DBLP

Journal of Computational Chemistry
1998, volume: 19, number: 13

  1. Michael R. Salazar, Richard L. Bell
    General methodology in two dimensions for classical simulation of reactive and nonreactive events on ab initio potential energy surfaces. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1998, v:19, n:13, pp:1431-1444 [Journal]
  2. Ioan Andricioaei, John E. Straub
    Global optimization using bad derivatives: Derivative-free method for molecular energy minimization. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1998, v:19, n:13, pp:1445-1455 [Journal]
  3. Dennis S. Marynick
    Accurate molecular electrostatic potentials based on modified PRDDO/M wave functions: III. Extension of the PESP method for calculation of electrostatic potential-derived atomic charges to compounds containing Li+, Na+, Mg2+, K+, Ca2+, Zn2+, and I. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1998, v:19, n:13, pp:1456-1469 [Journal]
  4. Christian Th. Klein, Bernd Mayer, Gottfried Köhler, Peter Wolschann
    Systematic stepsize variation: Efficient method for searching conformational space of polypeptides. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1998, v:19, n:13, pp:1470-1481 [Journal]
  5. Brian J. Smith, Nathan E. Hall
    Atomic radii: Incorporation of solvation effects. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1998, v:19, n:13, pp:1482-1493 [Journal]
  6. Enrico O. Purisima
    Fast summation boundary element method for calculating solvation free energies of macromolecules. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1998, v:19, n:13, pp:1494-1504 [Journal]
  7. D. Benjamin Gordon, Stephen L. Mayo
    Radical performance enhancements for combinatorial optimization algorithms based on the dead-end elimination theorem. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1998, v:19, n:13, pp:1505-1514 [Journal]
  8. Oreola Donini, Donald F. Weaver
    Development of modified force field for cation-amino acid interactions: Ab initio-derived empirical correction terms with comments on cation- interactions. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1998, v:19, n:13, pp:1515-1525 [Journal]
  9. Young-Kyu Han, Cheolbeom Bae, Yoon Sup Lee, Sang Yeon Lee
    Spin-orbit effects on structures of closed-shell polyatomic molecules containing heavy atoms calculated by two-component Hartree-Fock method. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1998, v:19, n:13, pp:1526-1533 [Journal]
  10. Helmut Grubmüller, Paul Tavan
    Multiple time step algorithms for molecular dynamics simulations of proteins: How good are they? [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1998, v:19, n:13, pp:1534-1552 [Journal]
  11. Kenneth G. Dyall
    Review of Relativistic Effects in Chemistry Part A: Theory and Techniques. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1998, v:19, n:13, pp:1553-1554 [Journal]
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