Journals in DBLP

Journal of Computational Chemistry
1997, volume: 18, number: 8

1. Xiaoping Cao, Yan Wang
   Molecular symmetry and ab initio calculations: IV. Symmetry-matrix and symmetry-supermatrix in calculations of two-electron repulsion integrals. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1997, v:18, n:8, pp:971-979 [Journal]
   
2. Robert Soliva, Modesto Orozco, F. Javier Luque
   Suitability of density functional methods for calculation of electrostatic properties. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1997, v:18, n:8, pp:980-991 [Journal]
   
3. Josep Maria Anglada, Josep Maria Bofill
   A reduced-restricted-quasi-Newton-Raphson method for locating and optimizing energy crossing points between two potential energy surfaces. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1997, v:18, n:8, pp:992-1003 [Journal]
   
4. Struan H. Robertson, Michael J. Pilling, Kevin E. Gates, Sean C. Smith
   Application of inverse iteration to 2-dimensional master equations. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1997, v:18, n:8, pp:1004-1010 [Journal]
   
5. J. Papadakis, George S. Fanourgakis, Stavros C. Farantos, M. Founargiotakis
   Comparison of line search minimization algorithms for exploring topography of multidimensional potential energy surfaces: Mg⁺Ar_n case. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1997, v:18, n:8, pp:1011-1022 [Journal]
   
6. Rainer Glaser, Grace Shiahuy Chen, Hansjfrg Grützmacher
   Effects of electron correlation and spin projection on rotational barriers of trithiocarbenium ion [C(SH)³]₊ and Radical Dication [C(SH)³]_{, 2+}. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1997, v:18, n:8, pp:1023-1035 [Journal]
   
7. Bouke P. van Eijck, Jan Kroon
   Fast clustering of equivalent structures in crystal structure prediction. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1997, v:18, n:8, pp:1036-1042 [Journal]
   
8. Delphine Flatters, Krystyna Zakrzewska, Richard Lavery
   Internal coordinate modeling of DNA: Force field comparisons. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1997, v:18, n:8, pp:1043-1055 [Journal]
   
9. Marc C. Nicklaus
   Conformational energies calculated by the molecular mechanics program CHARMm. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1997, v:18, n:8, pp:1056-1060 [Journal]
   
10. Jiali Gao
    Energy components of aqueous solution: Insight from hybrid QM/MM simulations using a polarizable solvent model. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:8, pp:1061-1071 [Journal]
    
11. Joseph D. Augspurger, Harold A. Scheraga
    An assessment of the accuracy of the RRIGS hydration potential: Comparison to solutions of the Poisson-Boltzmann equation. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:8, pp:1072-1078 [Journal]
    
12. Jon Baker
    Constrained optimization in delocalized internal coordinates. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:8, pp:1079-1095 [Journal]
    
13. Wayne J. Pullan
    Energy minimization of mixed argon-xenon microclusters using a genetic algorithm. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1997, v:18, n:8, pp:1096-1111 [Journal]