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Journals in DBLP

Journal of Computational Chemistry
2003, volume: 24, number: 16

  1. Jean-Philip Piquemal, Benjamin Williams-Hubbard, Natalie Fey, Robert J. Deeth, Nohad Gresh, Claude Giessner-Prettre
    Inclusion of the ligand field contribution in a polarizable molecular mechanics: SIBFA-LF. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2003, v:24, n:16, pp:1963-1970 [Journal]
  2. Pablo A. Molina, Hui Li, Jan H. Jensen
    Intraprotein electrostatics derived from first principles: Divide-and-conquer approaches for QM/MM calculations. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2003, v:24, n:16, pp:1971-1979 [Journal]
  3. Thomas E. Exner, Paul G. Mezey
    Ab initio quality properties for macromolecules using the ADMA approach. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2003, v:24, n:16, pp:1980-1986 [Journal]
  4. Chia-En Chang, Michael K. Gilson
    Tork: Conformational analysis method for molecules and complexes. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2003, v:24, n:16, pp:1987-1998 [Journal]
  5. Yong Duan, Chun Wu, Shibasish Chowdhury, Mathew C. Lee, Guoming Xiong, Wei Zhang, Rong Yang, Piotr Cieplak, Ray Luo, Taisung Lee, James W. Caldwell, Junmei Wang, Peter A. Kollman
    A point-charge force field for molecular mechanics simulations of proteins based on condensed-phase quantum mechanical calculations. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2003, v:24, n:16, pp:1999-2012 [Journal]
  6. Karl Jug, Gerald Geudtner
    Bond energies for molecules, clusters, and deposit systems. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2003, v:24, n:16, pp:2013-2022 [Journal]
  7. L. Claes, J.-P. François, M. S. Deleuze
    Theoretical study of the internal elimination reactions of xanthate precursors. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2003, v:24, n:16, pp:2023-2031 [Journal]
  8. Jorng-Tzong Horng, Hsien-Da Huang, Shih-Hsien Wang, Ming-You Chen, Shir-Ly Huang, Jenn-Kang Hwang
    Computing motif correlations in proteins. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2003, v:24, n:16, pp:2032-2043 [Journal]
  9. Pedro Braña, José A. Sordo
    Theoretical approach to the mechanism of reactions between halogen atoms and unsaturated hydrocarbons: The Cl + propene reaction. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2003, v:24, n:16, pp:2044-2062 [Journal]
  10. Qing Zhang, Daniel A. Beard, Tamar Schlick
    Constructing irregular surfaces to enclose macromolecular complexes for mesoscale modeling using the discrete surface charge optimization (DISCO) algorithm. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2003, v:24, n:16, pp:2063-2074 [Journal]
  11. E. Valderrama, R. J. Wheatley
    An environmental pseudopotential approach to molecular interactions: Implementation in MOLPRO. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2003, v:24, n:16, pp:2075-2082 [Journal]
  12. Satoshi Yokojima, Guanhua Chen, Ruixue Xu, Yijing Yan
    A dynamic mean field theory for dissipative interacting many-electron systems: Markovian formalism and its implementation. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2003, v:24, n:16, pp:2083-2092 [Journal]
  13. Alberto Del Rio, Abdou Boucekkine, Jean Meinnel
    Reassessment of methyl rotation barriers and conformations by correlated quantum chemistry methods. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2003, v:24, n:16, pp:2093-2100 [Journal]
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