Journals in DBLP

Journal of Computational Chemistry
2004, volume: 25, number: 4

1. Yi Ren, San-Yan Chu
   Modified Gaussian-2 level investigation of the identity ion-pair SN2 reactions of lithium halide and methyl halide with inversion and retention mechanisms. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 2004, v:25, n:4, pp:461-471 [Journal]
   
2. Lingchun Song, Wei Wu, Qianer Zhang, Sason Shaik
   A practical valence bond method: A configuration interaction method approach with perturbation theoretic facility. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 2004, v:25, n:4, pp:472-478 [Journal]
   
3. Emilio Gallicchio, Ronald M. Levy
   AGBNP: An analytic implicit solvent model suitable for molecular dynamics simulations and high-resolution modeling. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 2004, v:25, n:4, pp:479-499 [Journal]
   
4. Xiang-Yuan Li, Ke-Xiang Fu
   Continuous medium theory for nonequilibrium solvation: I. How to correctly evaluate solvation free energy of nonequilibrium. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 2004, v:25, n:4, pp:500-509 [Journal]
   
5. Evangelos A. Coutsias, Chaok Seok, Matthew P. Jacobson, Ken A. Dill
   A kinematic view of loop closure. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 2004, v:25, n:4, pp:510-528 [Journal]
   
6. Mitsunori Ikeguchi
   Partial rigid-body dynamics in NPT, NPAT and NPT ensembles for proteins and membranes. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 2004, v:25, n:4, pp:529-541 [Journal]
   
7. Michael J. Liddell, Davor Margetic, Anthony S. Mitchell, Ronald N. Warrener
   An AM1 semiempirical study of host-guest complexation in hemicarcerand complexes. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 2004, v:25, n:4, pp:542-557 [Journal]
   
8. Li Wang, Jing-Yao Liu, Ze-Sheng Li, Chia-Chung Sun
   Direct ab initio dynamics studies on the hydrogen-abstraction reactions of OH radicals with HOX (X = F, Cl, and Br). [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 2004, v:25, n:4, pp:558-564 [Journal]
   
9. S. Banu Ozkan, Hagai Meirovitch
   Conformational search of peptides and proteins: Monte Carlo minimization with an adaptive bias method applied to the heptapeptide deltorphin. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 2004, v:25, n:4, pp:565-572 [Journal]
   
10. Francisco Corzana, Mohammed S. Motawia, Catherine Hervé du Penhoat, Serge Pérez, Sarah M. Tschampel, Robert J. Woods, Søren Balling Engelsen
    A hydration study of (1->4) and (1->6) linked alpha-glucans by comparative 10 ns molecular dynamics simulations and 500-MHz NMR. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2004, v:25, n:4, pp:573-586 [Journal]
    
11. Johannes Neugebauer, Markus Reiher
    Vibrational center-ligand couplings in transition metal complexes. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2004, v:25, n:4, pp:587-597 [Journal]
    
12. Shinichi Yamabe, Noriko Tsuchida
    A computational study of the role of hydrogen bonds in SN1 and E1 reactions. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2004, v:25, n:4, pp:598-608 [Journal]
    
13. Maxim Totrov
    Accurate and efficient generalized born model based on solvent accessibility: Derivation and application for LogP octanol/water prediction and flexible peptide docking. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2004, v:25, n:4, pp:609-619 [Journal]