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Journals in DBLP

Journal of Computational Chemistry
2005, volume: 26, number: 7

  1. Eva Darian, Vladimir Hnizdo, Adam Fedorowicz, Harshinder Singh, Eugene Demchuk
    Estimation of the absolute internal-rotation entropy of molecules with two torsional degrees of freedom from stochastic simulations. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2005, v:26, n:7, pp:651-660 [Journal]
  2. Marcus Lundberg, Per E. M. Siegbahn
    Agreement between experiment and hybrid DFT calculations for OH bond dissociation enthalpies in manganese complexes. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2005, v:26, n:7, pp:661-667 [Journal]
  3. Peter A. Sims, Chung F. Wong, Danka Vuga, James Andrew McCammon, Bartholomew M. Sefton
    Relative contributions of desolvation, inter- and intramolecular interactions to binding affinity in protein kinase systems. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2005, v:26, n:7, pp:668-681 [Journal]
  4. Eric J. Sorin, Vijay S. Pande
    Empirical force-field assessment: The interplay between backbone torsions and noncovalent term scaling. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2005, v:26, n:7, pp:682-690 [Journal]
  5. Min-Yi Shen, Karl F. Freed
    A simple method for faster nonbonded force evaluations. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2005, v:26, n:7, pp:691-698 [Journal]
  6. L. Renee Olano, Steven W. Rick
    Fluctuating charge normal modes: An algorithm for implementing molecular dynamics simulations with polarizable potentials. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2005, v:26, n:7, pp:699-707 [Journal]
  7. Alán Aspuru-Guzik, Romelia Salomón-Ferrer, Brian Austin, William A. Lester Jr.
    A sparse algorithm for the evaluation of the local energy in quantum Monte Carlo. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2005, v:26, n:7, pp:708-715 [Journal]
  8. Anti Liivat, Alvo Aabloo, John O. Thomas
    Development of a force field for Li2SiF6. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2005, v:26, n:7, pp:716-724 [Journal]
  9. Thereza A. Soares, Philippe H. Hünenberger, Mika A. Kastenholz, Vincent Kräutler, Thomas Lenz, Roberto D. Lins, Chris Oostenbrink, Wilfred F. van Gunsteren
    An improved nucleic acid parameter set for the GROMOS force field. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2005, v:26, n:7, pp:725-737 [Journal]
  10. Fredrik Blomgren, Sven Larsson
    Exploring the potential energy surface of retinal, a comparison of the performance of different methods. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2005, v:26, n:7, pp:738-742 [Journal]
  11. Neil Gohaud, Didier Bégué, Clovis Darrigan, Claude Pouchan
    New parallel software (P_Anhar) for anharmonic vibrational calculations: Application to (CH3Li)2. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2005, v:26, n:7, pp:743-754 [Journal]
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