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Journals in DBLP

Journal of Computational Chemistry
2006, volume: 27, number: 8

  1. Hiromi Nakai, Yasuaki Kikuchi
    Energy density analysis of cluster size dependence of surface-molecule interactions (II): Formate adsorption onto a Cu(111) surface. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2006, v:27, n:8, pp:917-925 [Journal]
  2. J. H. Van Lenthe, R. Zwaans, Huub J. J. Van Dam, M. F. Guest
    Starting SCF calculations by superposition of atomic densities. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2006, v:27, n:8, pp:926-932 [Journal]
  3. Ju Xie, Dacheng Feng, Shengyu Feng
    Theoretical study on the isomeric structures and the stability of silylenoid (Tsi)Cl2SiLi (Tsi = C(SiMe3)3). [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2006, v:27, n:8, pp:933-940 [Journal]
  4. Shiqi Zhou
    Rapidly convergent procedure to solve the density profile equation in the classical density functional theory. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2006, v:27, n:8, pp:941-947 [Journal]
  5. Kaori Fukuzawa, Yuto Komeiji, Yuji Mochizuki, Akifumi Kato, Tatsuya Nakano, Shigenori Tanaka
    Intra- and intermolecular interactions between cyclic-AMP receptor protein and DNA: Ab initio fragment molecular orbital study. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2006, v:27, n:8, pp:948-960 [Journal]
  6. K. Darowicki, W. Felisiak
    On the joint time-frequency characteristics of chemical oscillations. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2006, v:27, n:8, pp:961-965 [Journal]
  7. Alexandra T. P. Carvalho, P. A. Fernandes, Maria J. Ramos
    Determination of the pKa between the active site cysteines of thioredoxin and DsbA. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2006, v:27, n:8, pp:966-975 [Journal]
  8. Dmitri G. Fedorov, Kazuo Kitaura, Hui Li, Jan H. Jensen, Mark S. Gordon
    The polarizable continuum model (PCM) interfaced with the fragment molecular orbital method (FMO). [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2006, v:27, n:8, pp:976-985 [Journal]
  9. Zhi-Ru Li, Fang-Fang Wang, Di Wu, Ying Li, Wei Chen, Xiao-Ying Sun, Feng Long Gu, Yuriko Aoki
    Royal crown-shaped electride Li3-N3-Be containing two superatoms: New knowledge on aromaticity. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2006, v:27, n:8, pp:986-993 [Journal]
  10. Zhi-Xiang Wang, Wei Zhang, Chun Wu, Hongxing Lei, Piotr Cieplak, Yong Duan
    Erratum - Strike a balance: Optimization of backbone torsion parameters of AMBER polarizable force field for simulations of proteins and peptides. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2006, v:27, n:8, pp:994- [Journal]
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