Journals in DBLP
Matteo Ceccarelli , Piero Procacci , Massimo Marchi An ab initio force field for the cofactors of bacterial photosynthesis. [Citation Graph (0, 0)][DBLP ] Journal of Computational Chemistry, 2003, v:24, n:2, pp:129-142 [Journal ] Francesca Massi , John E. Straub Structural and dynamical analysis of the hydration of the Alzheimer's beta-amyloid peptide. [Citation Graph (0, 0)][DBLP ] Journal of Computational Chemistry, 2003, v:24, n:2, pp:143-153 [Journal ] Alexander V. Mitin , Jon Baker , Krzysztof Wolinski , Peter Pulay Parallel stored-integral and semidirect Hartree-Fock and DFT methods with data compression. [Citation Graph (0, 0)][DBLP ] Journal of Computational Chemistry, 2003, v:24, n:2, pp:154-160 [Journal ] Jose Manuel Hermida-Ramón , Steve Brdarski , Gunnar Karlström , Ulf Berg Inter- and intramolecular potential for the N-formylglycinamide-water system. A comparison between theoretical modeling and empirical force fields. [Citation Graph (0, 0)][DBLP ] Journal of Computational Chemistry, 2003, v:24, n:2, pp:161-176 [Journal ] Mireia Garcia-Viloca , Cristóbal Alhambra , Donald G. Truhlar , Jiali Gao Hydride transfer catalyzed by xylose isomerase: Mechanism and quantum effects. [Citation Graph (0, 0)][DBLP ] Journal of Computational Chemistry, 2003, v:24, n:2, pp:177-190 [Journal ] John L. Klepeis , Christodoulos A. Floudas Prediction of beta-sheet topology and disulfide bridges in polypeptides. [Citation Graph (0, 0)][DBLP ] Journal of Computational Chemistry, 2003, v:24, n:2, pp:191-208 [Journal ] Takumi Hori , Hideaki Takahashi , Tomoshige Nitta Hybrid QM/MM molecular dynamics simulations for an ionic SN2 reaction in the supercritical water: OH- + CH3Cl -> CH3OH + Cl-. [Citation Graph (0, 0)][DBLP ] Journal of Computational Chemistry, 2003, v:24, n:2, pp:209-221 [Journal ] Robert J. Petrella , Ioan Andricioaei , Bernard R. Brooks , Martin Karplus An improved method for nonbonded list generation: Rapid determination of near-neighbor pairs. [Citation Graph (0, 0)][DBLP ] Journal of Computational Chemistry, 2003, v:24, n:2, pp:222-231 [Journal ] D. Benjamin Gordon , Geoffrey K. Hom , Stephen L. Mayo , Niles A. Pierce Exact rotamer optimization for protein design. [Citation Graph (0, 0)][DBLP ] Journal of Computational Chemistry, 2003, v:24, n:2, pp:232-243 [Journal ] Satoshi Okumoto , Shinichi Yamabe Computational study of epoxy-amine reactions. [Citation Graph (0, 0)][DBLP ] Journal of Computational Chemistry, 2003, v:24, n:2, pp:244-253 [Journal ] Vsevolod Katritch , Maxim Totrov , Ruben Abagyan ICFF: A new method to incorporate implicit flexibility into an internal coordinate force field. [Citation Graph (0, 0)][DBLP ] Journal of Computational Chemistry, 2003, v:24, n:2, pp:254-265 [Journal ]