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Results: 1-7 |
Results: 7
Theoretical studies of nonenzymatic reaction pathways for the three reaction stages of the carboxylation of ribulose-1,5-bisphosphate
Authors: Zhan, CG Niu, SQ Ornstein, RL
Citation: Cg. Zhan et al., Theoretical studies of nonenzymatic reaction pathways for the three reaction stages of the carboxylation of ribulose-1,5-bisphosphate, J CHEM S P2, (1), 2001, pp. 23-29
Mobility of the active site bound paraoxon and sarin in zinc-phosphotriesterase by molecular dynamics simulation and quantum chemical calculation
Authors: Koca, J Zhan, CG Rittenhouse, RC Ornstein, RL
Citation: J. Koca et al., Mobility of the active site bound paraoxon and sarin in zinc-phosphotriesterase by molecular dynamics simulation and quantum chemical calculation, J AM CHEM S, 123(5), 2001, pp. 817-826
Energy barriers for alkaline hydrolysis of carboxylic acid esters in aqueous solution by reaction field calculations
Authors: Zhan, CG Landry, DW Ornstein, RL
Citation: Cg. Zhan et al., Energy barriers for alkaline hydrolysis of carboxylic acid esters in aqueous solution by reaction field calculations, J PHYS CH A, 104(32), 2000, pp. 7672-7678
Theoretical studies of fundamental pathways for alkaline hydrolysis of carboxylic acid esters in gas phase
Authors: Zhan, CG Landry, DW Ornstein, RL
Citation: Cg. Zhan et al., Theoretical studies of fundamental pathways for alkaline hydrolysis of carboxylic acid esters in gas phase, J AM CHEM S, 122(7), 2000, pp. 1522-1530
Reaction pathways and energy barriers for alkaline hydrolysis of carboxylic acid esters in water studied by a hybrid supermolecule-polarizable continuum approach
Authors: Zhan, CG Landry, DW Ornstein, RL
Citation: Cg. Zhan et al., Reaction pathways and energy barriers for alkaline hydrolysis of carboxylic acid esters in water studied by a hybrid supermolecule-polarizable continuum approach, J AM CHEM S, 122(11), 2000, pp. 2621-2627
Molecular dynamics simulations of a protein-protein dimer: Particle-mesh Ewald electrostatic model yields far superior results to standard cutoff model
Authors: de Souza, ON Ornstein, RL
Citation: On. De Souza et Rl. Ornstein, Molecular dynamics simulations of a protein-protein dimer: Particle-mesh Ewald electrostatic model yields far superior results to standard cutoff model, J BIO STRUC, 16(6), 1999, pp. 1205
Determination of two structural forms of catalytic bridging ligand in zinc-phosphotriesterase by molecular dynamics simulation and quantum chemical calculation
Authors: Zhan, CG de Souza, ON Rittenhouse, R Ornstein, RL
Citation: Cg. Zhan et al., Determination of two structural forms of catalytic bridging ligand in zinc-phosphotriesterase by molecular dynamics simulation and quantum chemical calculation, J AM CHEM S, 121(32), 1999, pp. 7279-7282
Risultati: 1-7 |