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Journal of Computational Chemistry|July 18, 2003
Alcohols, ethers, carbohydrates, and related compounds. II. The anomeric effectJenn-Huei Lii, Kuo-Hsiang Chen, Kathleen A Durkin, et al.Journal of Computational Chemistry|July 18, 2003
Alcohols, ethers, carbohydrates, and related compounds. III. The 1,2-dimethoxyethane systemJenn-Huei Lii, Kuo-Hsiang Chen, T Bruce Grindley, et al.Journal of Computational Chemistry|July 18, 2003
Exploring potential energy surfaces for chemical reactions: an overview of some practical methodsH Bernhard SchlegelJournal of Computational Chemistry|January 28, 2003
Ground and excited state CASPT2 geometry optimizations of small organic moleculesChristopher S Page, Massimo OlivucciJournal of Computational Chemistry|January 28, 2003
Boundary element solution of the linear Poisson-Boltzmann equation and a multipole method for the rapid calculation of forces on macromolecules in solutionA J Bordner, G A HuberJournal of Computational Chemistry|April 30, 2003
Chemometric study of liquid water simulations. I. The parameters of the TIP4P model potentialMarcelo Zaldini Hernandes, João Bosco P da Silva, Ricardo L LongoJournal of Computational Chemistry|April 30, 2003
About the calculation of exchange coupling constants in polynuclear transition metal complexesEliseo Ruiz, Antonio Rodríguez-Fortea, Joan Cano, et al.Journal of Computational Chemistry|August 20, 2003
Structural and dynamical properties of methane clathrate hydratesNiall J English, J M D MacelroyJournal of Computational Chemistry|August 20, 2003
A comparison of the mechanism for the reductive half-reaction between pea seedling and other copper amine oxidases (CAOs)Rajeev Prabhakar, Per E M SiegbahnJournal of Computational Chemistry|August 20, 2003
FDS: flexible ligand and receptor docking with a continuum solvent model and soft-core energy functionRichard D Taylor, Philip J Jewsbury, Jonathan W EssexPageof 598