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Journals in DBLP

Journal of Computational Chemistry
1996, volume: 17, number: 12

  1. Jun-Ichi Aihara, Sumio Oe, Mitsuho Yoshida, Eiji Osawa
    Further test of the isolated pentagon rule: Thermodynamic and kinetic stabilities of C84 fullerene isomers. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:12, pp:1387-1394 [Journal]
  2. Georgia B. McGaughey, Eugene L. Stewart, J. Phillip Bowen
    Ab initio and molecular mechanics (MM2 and MM3) calculations of positively charged conjugated nitrogen-containing compounds. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:12, pp:1395-1405 [Journal]
  3. Bernd Reindl, Timothy Clark, Paul von Ragué Schleyer
    A new method for empirical force field calculations on localized and delocalized carbocations. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:12, pp:1406-1430 [Journal]
  4. D. B. Chesnut, Edward F. C. Byrd
    Accurate estimation of correlation energies using locally dense basis sets. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:12, pp:1431-1443 [Journal]
  5. George L. Heard, Brian F. Yates
    Hybrid supermolecule-polarizable continuum approach to solvation: Application to the mechanism of the Stevens rearrangement. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:12, pp:1444-1452 [Journal]
  6. Betty Cheng, Akbar Nayeem, Harold A. Scheraga
    From secondary structure to three-dimensional structure: Improved dihedral angle probability distribution function for use with energy searches for native structures of polypeptides and proteins. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:12, pp:1453-1480 [Journal]
  7. Nohad Gresh, David R. Garmer
    Comparative binding energetics of Mg2+, Ca2+, Zn2+, and Cd2+ to biologically relevant ligands: Combined ab initio SCF supermolecule and molecular mechanics investigation. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:12, pp:1481-1495 [Journal]
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